Synthesis and crystal structure of a new Cu3Au-type ternary phase in the Au–In–Pd system: distribution of atoms over crystallographic positions

Ptashkina, E.A.; Kabanova, E.G.; Tursina, A.I.; Yatsenko, A.V.; Kuznetsov, V.N.

doi:10.1107/S2053229618001973

Synthesis and crystal structure of a new Cu₃Au-type ternary phase in the Au–In–Pd system: distribution of atoms over crystallographic positions

E. A. Ptashkina, E. G. Kabanova, A. I. Tursina, A. V. Yatsenko and V. N. Kuznetsov

A new Cu₃Au-type ternary phase (τ phase) is found in the AuPd-rich part of the Au–In–Pd system. It has a broad homogeneity range based on extensive (Pd,Au) and (In,Au) replacement, with the composition varying between Au_17.7In_25.3Pd_57.0 and Au_50.8In_16.2Pd_33.0. The occupancies of the crystallographic positions were studied by single-crystal X-ray diffraction for three samples of different composition. The sites with m $\overline{3}$ m symmetry are occupied by atoms with a smaller scattering power than the atoms located on 4/mmm sites. Two extreme structure models were refined. Within the first, the occupation type changes from (Au,In,Pd)₃(Pd,In) to (Au,Pd)₃(In,Pd,Au) with an increase in the Au gross content. For the second model, the occupation type (Au,In,Pd)₃(Pd,Au) remains essentially unchanged for all Au concentrations. Although the diffraction data do not allow the choice of one of these models, the latter model, where Au substitutes In on 4/mmm sites, seems to be preferable, since it agrees with the fact that the homogeneity range of the τ phase is inclined to the Au corner and provides the same occupation type for all the studied samples of different compositions.

Keywords: intermetallic compound; gold; palladium; indium; Cu₃Au structure type; mixed occupancy; Au–In–Pd ternary phase; crystal structure; valence electronic concentration; VEC.

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Supporting information

	Crystallographic Information File (CIF) https://doi.org/10.1107/S2053229618001973/qp3003sup1.cif Contains datablocks global, 1A, 1B, 2A, 2B, 3A, 3B
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30031Asup2.hkl Contains datablock 1A
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30031Bsup3.hkl Contains datablock 1B
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30032Asup4.hkl Contains datablock 2A
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30032Bsup5.hkl Contains datablock 2B
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30033Asup6.hkl Contains datablock 3A
	Structure factor file (CIF format) https://doi.org/10.1107/S2053229618001973/qp30033Bsup7.hkl Contains datablock 3B

CCDC references: 1821598; 1821597; 1821596; 1821595; 1821594; 1821593

Computing details top

For all structures, data collection: CAD-4 Diffractometer Control Software (Enraf–Nonius, 1993); data reduction: PROFIT (Strel'tsov & Zavodnik, 1989); program(s) used to refine structure: SHELXL2014 (Sheldrick, 2015); molecular graphics: DIAMOND (Brandenburg, 2007); software used to prepare material for publication: publCIF (Westrip, 2010).

Gold indium dipalladium (1A) top

Crystal data top

Au_1.23In_0.93Pd_1.84	Mo Kα radiation, λ = 0.71073 Å
M_r = 545.03	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 23.1–23.2°
a = 4.0340 (6) Å	µ = 88.69 mm⁻¹
V = 65.65 (3) Å³	T = 295 K
Z = 1	Irregular block, black
F(000) = 227	0.05 × 0.04 × 0.04 mm
D_x = 13.787 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.055
Radiation source: fine-focus sealed tube	θ_max = 44.8°, θ_min = 5.1°
profile data from ω scans	h = −8→8
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = −8→8
T_min = 0.108, T_max = 0.268	l = 0→8
1152 measured reflections	2 standard reflections every 120 min
79 independent reflections	intensity decay: none
74 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.0397P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.022	(Δ/σ)_max < 0.001
wR(F²) = 0.071	Δρ_max = 2.24 e Å⁻³
S = 1.09	Δρ_min = −1.84 e Å⁻³
79 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.019 (5)

Special details top

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd2	0.0000	0.0000	0.0000	0.0180 (4)	0.88 (7)
In1	0.0000	0.0000	0.0000	0.0180 (4)	0.12 (7)
Au3	0.0000	0.5000	0.5000	0.0162 (3)	0.4106
Pd4	0.0000	0.5000	0.5000	0.0162 (3)	0.32 (2)
In5	0.0000	0.5000	0.5000	0.0162 (3)	0.27 (2)

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd2	0.0180 (4)	0.0180 (4)	0.0180 (4)	0.000	0.000	0.000
In1	0.0180 (4)	0.0180 (4)	0.0180 (4)	0.000	0.000	0.000
Au3	0.0150 (3)	0.0167 (3)	0.0167 (3)	0.000	0.000	0.000
Pd4	0.0150 (3)	0.0167 (3)	0.0167 (3)	0.000	0.000	0.000
In5	0.0150 (3)	0.0167 (3)	0.0167 (3)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd2—In5ⁱ	2.8525 (4)	Au3—Pd2^ix	2.8525 (4)
Pd2—Au3	2.8525 (4)	Au3—In5^x	2.8525 (4)
Pd2—Pd4	2.8525 (4)	Au3—Pd4^vi	2.8525 (4)
Pd2—In5	2.8525 (4)	Au3—In1^ix	2.8525 (4)
Pd2—Au3ⁱⁱ	2.8525 (4)	Au3—Au3^x	2.8525 (4)
Pd2—In5ⁱⁱⁱ	2.8525 (4)	Au3—Pd4^vii	2.8525 (4)
Pd2—In5^iv	2.8525 (4)	Au3—Pd4^viii	2.8525 (4)
Pd2—Au3^v	2.8525 (4)	Pd4—In5^vi	2.8525 (4)
Pd2—In5^v	2.8525 (4)	Pd4—In5^vii	2.8525 (4)
Pd2—In5ⁱⁱ	2.8525 (4)	Pd4—In5^viii	2.8525 (4)
Pd2—Au3^iv	2.8525 (4)	Pd4—Pd2^ix	2.8525 (4)
Pd2—Au3ⁱⁱⁱ	2.8525 (4)	Pd4—In5^x	2.8525 (4)
In1—In5ⁱ	2.8525 (4)	Pd4—Pd4^vi	2.8525 (4)
In1—Au3	2.8525 (4)	Pd4—In1^ix	2.8525 (4)
In1—Pd4	2.8525 (4)	Pd4—Au3^x	2.8525 (4)
In1—In5	2.8525 (4)	Pd4—Pd4^vii	2.8525 (4)
In1—Au3ⁱⁱ	2.8525 (4)	Pd4—Pd4^viii	2.8525 (4)
In1—In5ⁱⁱⁱ	2.8525 (4)	In5—In5^vi	2.8525 (4)
In1—In5^iv	2.8525 (4)	In5—In5^vii	2.8525 (4)
In1—Au3^v	2.8525 (4)	In5—In5^viii	2.8525 (4)
In1—In5^v	2.8525 (4)	In5—Pd2^ix	2.8525 (4)
In1—In5ⁱⁱ	2.8525 (4)	In5—In5^x	2.8525 (4)
In1—Au3^iv	2.8525 (4)	In5—Pd4^vi	2.8525 (4)
In1—Au3ⁱⁱⁱ	2.8525 (4)	In5—In1^ix	2.8525 (4)
Au3—In5^vi	2.8525 (4)	In5—Au3^x	2.8525 (4)
Au3—In5^vii	2.8525 (4)	In5—Pd4^vii	2.8525 (4)
Au3—In5^viii	2.8525 (4)	In5—Pd4^viii	2.8525 (4)

In5ⁱ—Pd2—Au3	60.0	Pd2^ix—Au3—In1^ix	0.0
In5ⁱ—Pd2—Pd4	60.0	In5^x—Au3—In1^ix	120.0
Au3—Pd2—Pd4	0.0	Pd4^vi—Au3—In1^ix	60.0
In5ⁱ—Pd2—In5	60.0	In5^vi—Au3—Au3^x	120.0
Au3—Pd2—In5	0.0	Pd2—Au3—Au3^x	60.0
Pd4—Pd2—In5	0.0	In1—Au3—Au3^x	60.0
In5ⁱ—Pd2—Au3ⁱⁱ	120.0	In5^vii—Au3—Au3^x	60.0
Au3—Pd2—Au3ⁱⁱ	180.0	In5^viii—Au3—Au3^x	180.0
Pd4—Pd2—Au3ⁱⁱ	180.0	Pd2^ix—Au3—Au3^x	120.0
In5—Pd2—Au3ⁱⁱ	180.0	In5^x—Au3—Au3^x	0.0
In5ⁱ—Pd2—In5ⁱⁱⁱ	180.0	Pd4^vi—Au3—Au3^x	120.0
Au3—Pd2—In5ⁱⁱⁱ	120.0	In1^ix—Au3—Au3^x	120.0
Pd4—Pd2—In5ⁱⁱⁱ	120.0	In5^vi—Au3—Pd4^vii	180.0
In5—Pd2—In5ⁱⁱⁱ	120.0	Pd2—Au3—Pd4^vii	60.0
Au3ⁱⁱ—Pd2—In5ⁱⁱⁱ	60.0	In1—Au3—Pd4^vii	60.0
In5ⁱ—Pd2—In5^iv	60.0	In5^vii—Au3—Pd4^vii	0.0
Au3—Pd2—In5^iv	60.0	In5^viii—Au3—Pd4^vii	120.0
Pd4—Pd2—In5^iv	60.0	Pd2^ix—Au3—Pd4^vii	120.0
In5—Pd2—In5^iv	60.0	In5^x—Au3—Pd4^vii	60.0
Au3ⁱⁱ—Pd2—In5^iv	120.0	Pd4^vi—Au3—Pd4^vii	180.0
In5ⁱⁱⁱ—Pd2—In5^iv	120.0	In1^ix—Au3—Pd4^vii	120.0
In5ⁱ—Pd2—Au3^v	120.0	Au3^x—Au3—Pd4^vii	60.0
Au3—Pd2—Au3^v	120.0	In5^vi—Au3—Pd4^viii	60.0
Pd4—Pd2—Au3^v	120.0	Pd2—Au3—Pd4^viii	120.0
In5—Pd2—Au3^v	120.0	In1—Au3—Pd4^viii	120.0
Au3ⁱⁱ—Pd2—Au3^v	60.0	In5^vii—Au3—Pd4^viii	120.0
In5ⁱⁱⁱ—Pd2—Au3^v	60.0	In5^viii—Au3—Pd4^viii	0.0
In5^iv—Pd2—Au3^v	180.0	Pd2^ix—Au3—Pd4^viii	60.0
In5ⁱ—Pd2—In5^v	120.0	In5^x—Au3—Pd4^viii	180.0
Au3—Pd2—In5^v	120.0	Pd4^vi—Au3—Pd4^viii	60.0
Pd4—Pd2—In5^v	120.0	In1^ix—Au3—Pd4^viii	60.0
In5—Pd2—In5^v	120.0	Au3^x—Au3—Pd4^viii	180.0
Au3ⁱⁱ—Pd2—In5^v	60.0	Pd4^vii—Au3—Pd4^viii	120.0
In5ⁱⁱⁱ—Pd2—In5^v	60.0	In5^vi—Pd4—Pd2	120.0
In5^iv—Pd2—In5^v	180.0	In5^vi—Pd4—In1	120.0
Au3^v—Pd2—In5^v	0.0	Pd2—Pd4—In1	0.0
In5ⁱ—Pd2—In5ⁱⁱ	120.0	In5^vi—Pd4—In5^vii	180.0
Au3—Pd2—In5ⁱⁱ	180.0	Pd2—Pd4—In5^vii	60.0
Pd4—Pd2—In5ⁱⁱ	180.0	In1—Pd4—In5^vii	60.0
In5—Pd2—In5ⁱⁱ	180.0	In5^vi—Pd4—In5^viii	60.0
Au3ⁱⁱ—Pd2—In5ⁱⁱ	0.0	Pd2—Pd4—In5^viii	120.0
In5ⁱⁱⁱ—Pd2—In5ⁱⁱ	60.0	In1—Pd4—In5^viii	120.0
In5^iv—Pd2—In5ⁱⁱ	120.0	In5^vii—Pd4—In5^viii	120.0
Au3^v—Pd2—In5ⁱⁱ	60.0	In5^vi—Pd4—Pd2^ix	60.0
In5^v—Pd2—In5ⁱⁱ	60.0	Pd2—Pd4—Pd2^ix	180.0
In5ⁱ—Pd2—Au3^iv	60.0	In1—Pd4—Pd2^ix	180.0
Au3—Pd2—Au3^iv	60.0	In5^vii—Pd4—Pd2^ix	120.0
Pd4—Pd2—Au3^iv	60.0	In5^viii—Pd4—Pd2^ix	60.0
In5—Pd2—Au3^iv	60.0	In5^vi—Pd4—In5^x	120.0
Au3ⁱⁱ—Pd2—Au3^iv	120.0	Pd2—Pd4—In5^x	60.0
In5ⁱⁱⁱ—Pd2—Au3^iv	120.0	In1—Pd4—In5^x	60.0
In5^iv—Pd2—Au3^iv	0.0	In5^vii—Pd4—In5^x	60.0
Au3^v—Pd2—Au3^iv	180.0	In5^viii—Pd4—In5^x	180.0
In5^v—Pd2—Au3^iv	180.0	Pd2^ix—Pd4—In5^x	120.0
In5ⁱⁱ—Pd2—Au3^iv	120.0	In5^vi—Pd4—Pd4^vi	0.0
In5ⁱ—Pd2—Au3ⁱⁱⁱ	180.0	Pd2—Pd4—Pd4^vi	120.0
Au3—Pd2—Au3ⁱⁱⁱ	120.0	In1—Pd4—Pd4^vi	120.0
Pd4—Pd2—Au3ⁱⁱⁱ	120.0	In5^vii—Pd4—Pd4^vi	180.0
In5—Pd2—Au3ⁱⁱⁱ	120.0	In5^viii—Pd4—Pd4^vi	60.0
Au3ⁱⁱ—Pd2—Au3ⁱⁱⁱ	60.0	Pd2^ix—Pd4—Pd4^vi	60.0
In5ⁱⁱⁱ—Pd2—Au3ⁱⁱⁱ	0.0	In5^x—Pd4—Pd4^vi	120.0
In5^iv—Pd2—Au3ⁱⁱⁱ	120.0	In5^vi—Pd4—In1^ix	60.0
Au3^v—Pd2—Au3ⁱⁱⁱ	60.0	Pd2—Pd4—In1^ix	180.0
In5^v—Pd2—Au3ⁱⁱⁱ	60.0	In1—Pd4—In1^ix	180.0
In5ⁱⁱ—Pd2—Au3ⁱⁱⁱ	60.0	In5^vii—Pd4—In1^ix	120.0
Au3^iv—Pd2—Au3ⁱⁱⁱ	120.0	In5^viii—Pd4—In1^ix	60.0
In5ⁱ—In1—Au3	60.0	Pd2^ix—Pd4—In1^ix	0.0
In5ⁱ—In1—Pd4	60.0	In5^x—Pd4—In1^ix	120.0
Au3—In1—Pd4	0.0	Pd4^vi—Pd4—In1^ix	60.0
In5ⁱ—In1—In5	60.0	In5^vi—Pd4—Au3^x	120.0
Au3—In1—In5	0.0	Pd2—Pd4—Au3^x	60.0
Pd4—In1—In5	0.0	In1—Pd4—Au3^x	60.0
In5ⁱ—In1—Au3ⁱⁱ	120.0	In5^vii—Pd4—Au3^x	60.0
Au3—In1—Au3ⁱⁱ	180.0	In5^viii—Pd4—Au3^x	180.0
Pd4—In1—Au3ⁱⁱ	180.0	Pd2^ix—Pd4—Au3^x	120.0
In5—In1—Au3ⁱⁱ	180.0	In5^x—Pd4—Au3^x	0.0
In5ⁱ—In1—In5ⁱⁱⁱ	180.0	Pd4^vi—Pd4—Au3^x	120.0
Au3—In1—In5ⁱⁱⁱ	120.0	In1^ix—Pd4—Au3^x	120.0
Pd4—In1—In5ⁱⁱⁱ	120.0	In5^vi—Pd4—Pd4^vii	180.0
In5—In1—In5ⁱⁱⁱ	120.0	Pd2—Pd4—Pd4^vii	60.0
Au3ⁱⁱ—In1—In5ⁱⁱⁱ	60.0	In1—Pd4—Pd4^vii	60.0
In5ⁱ—In1—In5^iv	60.0	In5^vii—Pd4—Pd4^vii	0.0
Au3—In1—In5^iv	60.0	In5^viii—Pd4—Pd4^vii	120.0
Pd4—In1—In5^iv	60.0	Pd2^ix—Pd4—Pd4^vii	120.0
In5—In1—In5^iv	60.0	In5^x—Pd4—Pd4^vii	60.0
Au3ⁱⁱ—In1—In5^iv	120.0	Pd4^vi—Pd4—Pd4^vii	180.0
In5ⁱⁱⁱ—In1—In5^iv	120.0	In1^ix—Pd4—Pd4^vii	120.0
In5ⁱ—In1—Au3^v	120.0	Au3^x—Pd4—Pd4^vii	60.0
Au3—In1—Au3^v	120.0	In5^vi—Pd4—Pd4^viii	60.0
Pd4—In1—Au3^v	120.0	Pd2—Pd4—Pd4^viii	120.0
In5—In1—Au3^v	120.0	In1—Pd4—Pd4^viii	120.0
Au3ⁱⁱ—In1—Au3^v	60.0	In5^vii—Pd4—Pd4^viii	120.0
In5ⁱⁱⁱ—In1—Au3^v	60.0	In5^viii—Pd4—Pd4^viii	0.0
In5^iv—In1—Au3^v	180.0	Pd2^ix—Pd4—Pd4^viii	60.0
In5ⁱ—In1—In5^v	120.0	In5^x—Pd4—Pd4^viii	180.0
Au3—In1—In5^v	120.0	Pd4^vi—Pd4—Pd4^viii	60.0
Pd4—In1—In5^v	120.0	In1^ix—Pd4—Pd4^viii	60.0
In5—In1—In5^v	120.0	Au3^x—Pd4—Pd4^viii	180.0
Au3ⁱⁱ—In1—In5^v	60.0	Pd4^vii—Pd4—Pd4^viii	120.0
In5ⁱⁱⁱ—In1—In5^v	60.0	In5^vi—In5—Pd2	120.0
In5^iv—In1—In5^v	180.0	In5^vi—In5—In1	120.0
Au3^v—In1—In5^v	0.0	Pd2—In5—In1	0.0
In5ⁱ—In1—In5ⁱⁱ	120.0	In5^vi—In5—In5^vii	180.0
Au3—In1—In5ⁱⁱ	180.0	Pd2—In5—In5^vii	60.0
Pd4—In1—In5ⁱⁱ	180.0	In1—In5—In5^vii	60.0
In5—In1—In5ⁱⁱ	180.0	In5^vi—In5—In5^viii	60.0
Au3ⁱⁱ—In1—In5ⁱⁱ	0.0	Pd2—In5—In5^viii	120.0
In5ⁱⁱⁱ—In1—In5ⁱⁱ	60.0	In1—In5—In5^viii	120.0
In5^iv—In1—In5ⁱⁱ	120.0	In5^vii—In5—In5^viii	120.0
Au3^v—In1—In5ⁱⁱ	60.0	In5^vi—In5—Pd2^ix	60.0
In5^v—In1—In5ⁱⁱ	60.0	Pd2—In5—Pd2^ix	180.0
In5ⁱ—In1—Au3^iv	60.0	In1—In5—Pd2^ix	180.0
Au3—In1—Au3^iv	60.0	In5^vii—In5—Pd2^ix	120.0
Pd4—In1—Au3^iv	60.0	In5^viii—In5—Pd2^ix	60.0
In5—In1—Au3^iv	60.0	In5^vi—In5—In5^x	120.0
Au3ⁱⁱ—In1—Au3^iv	120.0	Pd2—In5—In5^x	60.0
In5ⁱⁱⁱ—In1—Au3^iv	120.0	In1—In5—In5^x	60.0
In5^iv—In1—Au3^iv	0.0	In5^vii—In5—In5^x	60.0
Au3^v—In1—Au3^iv	180.0	In5^viii—In5—In5^x	180.0
In5^v—In1—Au3^iv	180.0	Pd2^ix—In5—In5^x	120.0
In5ⁱⁱ—In1—Au3^iv	120.0	In5^vi—In5—Pd4^vi	0.0
In5ⁱ—In1—Au3ⁱⁱⁱ	180.0	Pd2—In5—Pd4^vi	120.0
Au3—In1—Au3ⁱⁱⁱ	120.0	In1—In5—Pd4^vi	120.0
Pd4—In1—Au3ⁱⁱⁱ	120.0	In5^vii—In5—Pd4^vi	180.0
In5—In1—Au3ⁱⁱⁱ	120.0	In5^viii—In5—Pd4^vi	60.0
Au3ⁱⁱ—In1—Au3ⁱⁱⁱ	60.0	Pd2^ix—In5—Pd4^vi	60.0
In5ⁱⁱⁱ—In1—Au3ⁱⁱⁱ	0.0	In5^x—In5—Pd4^vi	120.0
In5^iv—In1—Au3ⁱⁱⁱ	120.0	In5^vi—In5—In1^ix	60.0
Au3^v—In1—Au3ⁱⁱⁱ	60.0	Pd2—In5—In1^ix	180.0
In5^v—In1—Au3ⁱⁱⁱ	60.0	In1—In5—In1^ix	180.0
In5ⁱⁱ—In1—Au3ⁱⁱⁱ	60.0	In5^vii—In5—In1^ix	120.0
Au3^iv—In1—Au3ⁱⁱⁱ	120.0	In5^viii—In5—In1^ix	60.0
In5^vi—Au3—Pd2	120.0	Pd2^ix—In5—In1^ix	0.0
In5^vi—Au3—In1	120.0	In5^x—In5—In1^ix	120.0
Pd2—Au3—In1	0.0	Pd4^vi—In5—In1^ix	60.0
In5^vi—Au3—In5^vii	180.0	In5^vi—In5—Au3^x	120.0
Pd2—Au3—In5^vii	60.0	Pd2—In5—Au3^x	60.0
In1—Au3—In5^vii	60.0	In1—In5—Au3^x	60.0
In5^vi—Au3—In5^viii	60.0	In5^vii—In5—Au3^x	60.0
Pd2—Au3—In5^viii	120.0	In5^viii—In5—Au3^x	180.0
In1—Au3—In5^viii	120.0	Pd2^ix—In5—Au3^x	120.0
In5^vii—Au3—In5^viii	120.0	In5^x—In5—Au3^x	0.0
In5^vi—Au3—Pd2^ix	60.0	Pd4^vi—In5—Au3^x	120.0
Pd2—Au3—Pd2^ix	180.0	In1^ix—In5—Au3^x	120.0
In1—Au3—Pd2^ix	180.0	In5^vi—In5—Pd4^vii	180.0
In5^vii—Au3—Pd2^ix	120.0	Pd2—In5—Pd4^vii	60.0
In5^viii—Au3—Pd2^ix	60.0	In1—In5—Pd4^vii	60.0
In5^vi—Au3—In5^x	120.0	In5^vii—In5—Pd4^vii	0.0
Pd2—Au3—In5^x	60.0	In5^viii—In5—Pd4^vii	120.0
In1—Au3—In5^x	60.0	Pd2^ix—In5—Pd4^vii	120.0
In5^vii—Au3—In5^x	60.0	In5^x—In5—Pd4^vii	60.0
In5^viii—Au3—In5^x	180.0	Pd4^vi—In5—Pd4^vii	180.0
Pd2^ix—Au3—In5^x	120.0	In1^ix—In5—Pd4^vii	120.0
In5^vi—Au3—Pd4^vi	0.0	Au3^x—In5—Pd4^vii	60.0
Pd2—Au3—Pd4^vi	120.0	In5^vi—In5—Pd4^viii	60.0
In1—Au3—Pd4^vi	120.0	Pd2—In5—Pd4^viii	120.0
In5^vii—Au3—Pd4^vi	180.0	In1—In5—Pd4^viii	120.0
In5^viii—Au3—Pd4^vi	60.0	In5^vii—In5—Pd4^viii	120.0
Pd2^ix—Au3—Pd4^vi	60.0	In5^viii—In5—Pd4^viii	0.0
In5^x—Au3—Pd4^vi	120.0	Pd2^ix—In5—Pd4^viii	60.0
In5^vi—Au3—In1^ix	60.0	In5^x—In5—Pd4^viii	180.0
Pd2—Au3—In1^ix	180.0	Pd4^vi—In5—Pd4^viii	60.0
In1—Au3—In1^ix	180.0	In1^ix—In5—Pd4^viii	60.0
In5^vii—Au3—In1^ix	120.0	Au3^x—In5—Pd4^viii	180.0
In5^viii—Au3—In1^ix	60.0	Pd4^vii—In5—Pd4^viii	120.0

Symmetry codes: (i) y, z, x; (ii) x, y−1, z−1; (iii) y−1, z−1, x; (iv) −y+1, x, z; (v) −y, x, z−1; (vi) y, z, x+1; (vii) y−1, z, x; (viii) −y+1, x+1, z; (ix) x, y+1, z+1; (x) −y, x, z.

Gold indium dipalladium (1B) top

Crystal data top

Au_1.23In_0.93Pd_1.84	Mo Kα radiation, λ = 0.71073 Å
M_r = 545.03	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 23.1–23.2°
a = 4.0340 (6) Å	µ = 88.69 mm⁻¹
V = 65.65 (3) Å³	T = 295 K
Z = 1	Irregular block, black
F(000) = 227	0.05 × 0.04 × 0.04 mm
D_x = 13.787 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.055
Radiation source: fine-focus sealed tube	θ_max = 44.8°, θ_min = 5.1°
profile data from ω scans	h = −8→8
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = −8→8
T_min = 0.108, T_max = 0.268	l = 0→8
1152 measured reflections	2 standard reflections every 120 min
79 independent reflections	intensity decay: none
74 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.0407P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.022	(Δ/σ)_max < 0.001
wR(F²) = 0.073	Δρ_max = 2.07 e Å⁻³
S = 1.09	Δρ_min = −1.38 e Å⁻³
79 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.016 (5)

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd1	0.0000	0.0000	0.0000	0.0177 (5)	0.994 (8)
Au2	0.0000	0.0000	0.0000	0.0177 (5)	0.005 (8)
Pd5	0.0000	0.5000	0.5000	0.0160 (3)	0.281 (3)
Au3	0.0000	0.5000	0.5000	0.0160 (3)	0.409 (3)
In4	0.0000	0.5000	0.5000	0.0160 (3)	0.3107

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd1	0.0177 (5)	0.0177 (5)	0.0177 (5)	0.000	0.000	0.000
Au2	0.0177 (5)	0.0177 (5)	0.0177 (5)	0.000	0.000	0.000
Pd5	0.0149 (3)	0.0166 (3)	0.0166 (3)	0.000	0.000	0.000
Au3	0.0149 (3)	0.0166 (3)	0.0166 (3)	0.000	0.000	0.000
In4	0.0149 (3)	0.0166 (3)	0.0166 (3)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd1—In4ⁱ	2.8525 (4)	Pd5—Pd1^ix	2.8525 (4)
Pd1—Pd5	2.8525 (4)	Pd5—In4^x	2.8525 (4)
Pd1—Au3	2.8525 (4)	Pd5—Au3^vi	2.8525 (4)
Pd1—In4	2.8525 (4)	Pd5—Au2^ix	2.8525 (4)
Pd1—Pd5ⁱⁱ	2.8525 (4)	Pd5—Pd5^x	2.8525 (4)
Pd1—In4ⁱⁱⁱ	2.8525 (4)	Pd5—Au3^vii	2.8525 (4)
Pd1—In4^iv	2.8525 (4)	Pd5—Au3^viii	2.8525 (4)
Pd1—Pd5^v	2.8525 (4)	Au3—In4^vi	2.8525 (4)
Pd1—In4^v	2.8525 (4)	Au3—In4^vii	2.8525 (4)
Pd1—In4ⁱⁱ	2.8525 (4)	Au3—In4^viii	2.8525 (4)
Pd1—Pd5^iv	2.8525 (4)	Au3—Pd1^ix	2.8525 (4)
Pd1—Pd5ⁱⁱⁱ	2.8525 (4)	Au3—In4^x	2.8525 (4)
Au2—In4ⁱ	2.8525 (4)	Au3—Au3^vi	2.8525 (4)
Au2—Pd5	2.8525 (4)	Au3—Au2^ix	2.8525 (4)
Au2—Au3	2.8525 (4)	Au3—Pd5^x	2.8525 (4)
Au2—In4	2.8525 (4)	Au3—Au3^vii	2.8525 (4)
Au2—Pd5ⁱⁱ	2.8525 (4)	Au3—Au3^viii	2.8525 (4)
Au2—In4ⁱⁱⁱ	2.8525 (4)	In4—In4^vi	2.8525 (4)
Au2—In4^iv	2.8525 (4)	In4—In4^vii	2.8525 (4)
Au2—Pd5^v	2.8525 (4)	In4—In4^viii	2.8525 (4)
Au2—In4^v	2.8525 (4)	In4—Pd1^ix	2.8525 (4)
Au2—In4ⁱⁱ	2.8525 (4)	In4—In4^x	2.8525 (4)
Au2—Pd5^iv	2.8525 (4)	In4—Au3^vi	2.8525 (4)
Au2—Pd5ⁱⁱⁱ	2.8525 (4)	In4—Au2^ix	2.8525 (4)
Pd5—In4^vi	2.8525 (4)	In4—Pd5^x	2.8525 (4)
Pd5—In4^vii	2.8525 (4)	In4—Au3^vii	2.8525 (4)
Pd5—In4^viii	2.8525 (4)	In4—Au3^viii	2.8525 (4)

In4ⁱ—Pd1—Pd5	60.0	Pd1^ix—Pd5—Au2^ix	0.0
In4ⁱ—Pd1—Au3	60.0	In4^x—Pd5—Au2^ix	120.0
Pd5—Pd1—Au3	0.0	Au3^vi—Pd5—Au2^ix	60.0
In4ⁱ—Pd1—In4	60.0	In4^vi—Pd5—Pd5^x	120.0
Pd5—Pd1—In4	0.0	Pd1—Pd5—Pd5^x	60.0
Au3—Pd1—In4	0.0	Au2—Pd5—Pd5^x	60.0
In4ⁱ—Pd1—Pd5ⁱⁱ	120.0	In4^vii—Pd5—Pd5^x	60.0
Pd5—Pd1—Pd5ⁱⁱ	180.0	In4^viii—Pd5—Pd5^x	180.0
Au3—Pd1—Pd5ⁱⁱ	180.0	Pd1^ix—Pd5—Pd5^x	120.0
In4—Pd1—Pd5ⁱⁱ	180.0	In4^x—Pd5—Pd5^x	0.0
In4ⁱ—Pd1—In4ⁱⁱⁱ	180.0	Au3^vi—Pd5—Pd5^x	120.0
Pd5—Pd1—In4ⁱⁱⁱ	120.0	Au2^ix—Pd5—Pd5^x	120.0
Au3—Pd1—In4ⁱⁱⁱ	120.0	In4^vi—Pd5—Au3^vii	180.0
In4—Pd1—In4ⁱⁱⁱ	120.0	Pd1—Pd5—Au3^vii	60.0
Pd5ⁱⁱ—Pd1—In4ⁱⁱⁱ	60.0	Au2—Pd5—Au3^vii	60.0
In4ⁱ—Pd1—In4^iv	60.0	In4^vii—Pd5—Au3^vii	0.0
Pd5—Pd1—In4^iv	60.0	In4^viii—Pd5—Au3^vii	120.0
Au3—Pd1—In4^iv	60.0	Pd1^ix—Pd5—Au3^vii	120.0
In4—Pd1—In4^iv	60.0	In4^x—Pd5—Au3^vii	60.0
Pd5ⁱⁱ—Pd1—In4^iv	120.0	Au3^vi—Pd5—Au3^vii	180.0
In4ⁱⁱⁱ—Pd1—In4^iv	120.0	Au2^ix—Pd5—Au3^vii	120.0
In4ⁱ—Pd1—Pd5^v	120.0	Pd5^x—Pd5—Au3^vii	60.0
Pd5—Pd1—Pd5^v	120.0	In4^vi—Pd5—Au3^viii	60.0
Au3—Pd1—Pd5^v	120.0	Pd1—Pd5—Au3^viii	120.0
In4—Pd1—Pd5^v	120.0	Au2—Pd5—Au3^viii	120.0
Pd5ⁱⁱ—Pd1—Pd5^v	60.0	In4^vii—Pd5—Au3^viii	120.0
In4ⁱⁱⁱ—Pd1—Pd5^v	60.0	In4^viii—Pd5—Au3^viii	0.0
In4^iv—Pd1—Pd5^v	180.0	Pd1^ix—Pd5—Au3^viii	60.0
In4ⁱ—Pd1—In4^v	120.0	In4^x—Pd5—Au3^viii	180.0
Pd5—Pd1—In4^v	120.0	Au3^vi—Pd5—Au3^viii	60.0
Au3—Pd1—In4^v	120.0	Au2^ix—Pd5—Au3^viii	60.0
In4—Pd1—In4^v	120.0	Pd5^x—Pd5—Au3^viii	180.0
Pd5ⁱⁱ—Pd1—In4^v	60.0	Au3^vii—Pd5—Au3^viii	120.0
In4ⁱⁱⁱ—Pd1—In4^v	60.0	In4^vi—Au3—Pd1	120.0
In4^iv—Pd1—In4^v	180.0	In4^vi—Au3—Au2	120.0
Pd5^v—Pd1—In4^v	0.0	Pd1—Au3—Au2	0.0
In4ⁱ—Pd1—In4ⁱⁱ	120.0	In4^vi—Au3—In4^vii	180.0
Pd5—Pd1—In4ⁱⁱ	180.0	Pd1—Au3—In4^vii	60.0
Au3—Pd1—In4ⁱⁱ	180.0	Au2—Au3—In4^vii	60.0
In4—Pd1—In4ⁱⁱ	180.0	In4^vi—Au3—In4^viii	60.0
Pd5ⁱⁱ—Pd1—In4ⁱⁱ	0.0	Pd1—Au3—In4^viii	120.0
In4ⁱⁱⁱ—Pd1—In4ⁱⁱ	60.0	Au2—Au3—In4^viii	120.0
In4^iv—Pd1—In4ⁱⁱ	120.0	In4^vii—Au3—In4^viii	120.0
Pd5^v—Pd1—In4ⁱⁱ	60.0	In4^vi—Au3—Pd1^ix	60.0
In4^v—Pd1—In4ⁱⁱ	60.0	Pd1—Au3—Pd1^ix	180.0
In4ⁱ—Pd1—Pd5^iv	60.0	Au2—Au3—Pd1^ix	180.0
Pd5—Pd1—Pd5^iv	60.0	In4^vii—Au3—Pd1^ix	120.0
Au3—Pd1—Pd5^iv	60.0	In4^viii—Au3—Pd1^ix	60.0
In4—Pd1—Pd5^iv	60.0	In4^vi—Au3—In4^x	120.0
Pd5ⁱⁱ—Pd1—Pd5^iv	120.0	Pd1—Au3—In4^x	60.0
In4ⁱⁱⁱ—Pd1—Pd5^iv	120.0	Au2—Au3—In4^x	60.0
In4^iv—Pd1—Pd5^iv	0.0	In4^vii—Au3—In4^x	60.0
Pd5^v—Pd1—Pd5^iv	180.0	In4^viii—Au3—In4^x	180.0
In4^v—Pd1—Pd5^iv	180.0	Pd1^ix—Au3—In4^x	120.0
In4ⁱⁱ—Pd1—Pd5^iv	120.0	In4^vi—Au3—Au3^vi	0.0
In4ⁱ—Pd1—Pd5ⁱⁱⁱ	180.0	Pd1—Au3—Au3^vi	120.0
Pd5—Pd1—Pd5ⁱⁱⁱ	120.0	Au2—Au3—Au3^vi	120.0
Au3—Pd1—Pd5ⁱⁱⁱ	120.0	In4^vii—Au3—Au3^vi	180.0
In4—Pd1—Pd5ⁱⁱⁱ	120.0	In4^viii—Au3—Au3^vi	60.0
Pd5ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	Pd1^ix—Au3—Au3^vi	60.0
In4ⁱⁱⁱ—Pd1—Pd5ⁱⁱⁱ	0.0	In4^x—Au3—Au3^vi	120.0
In4^iv—Pd1—Pd5ⁱⁱⁱ	120.0	In4^vi—Au3—Au2^ix	60.0
Pd5^v—Pd1—Pd5ⁱⁱⁱ	60.0	Pd1—Au3—Au2^ix	180.0
In4^v—Pd1—Pd5ⁱⁱⁱ	60.0	Au2—Au3—Au2^ix	180.0
In4ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	In4^vii—Au3—Au2^ix	120.0
Pd5^iv—Pd1—Pd5ⁱⁱⁱ	120.0	In4^viii—Au3—Au2^ix	60.0
In4ⁱ—Au2—Pd5	60.0	Pd1^ix—Au3—Au2^ix	0.0
In4ⁱ—Au2—Au3	60.0	In4^x—Au3—Au2^ix	120.0
Pd5—Au2—Au3	0.0	Au3^vi—Au3—Au2^ix	60.0
In4ⁱ—Au2—In4	60.0	In4^vi—Au3—Pd5^x	120.0
Pd5—Au2—In4	0.0	Pd1—Au3—Pd5^x	60.0
Au3—Au2—In4	0.0	Au2—Au3—Pd5^x	60.0
In4ⁱ—Au2—Pd5ⁱⁱ	120.0	In4^vii—Au3—Pd5^x	60.0
Pd5—Au2—Pd5ⁱⁱ	180.0	In4^viii—Au3—Pd5^x	180.0
Au3—Au2—Pd5ⁱⁱ	180.0	Pd1^ix—Au3—Pd5^x	120.0
In4—Au2—Pd5ⁱⁱ	180.0	In4^x—Au3—Pd5^x	0.0
In4ⁱ—Au2—In4ⁱⁱⁱ	180.0	Au3^vi—Au3—Pd5^x	120.0
Pd5—Au2—In4ⁱⁱⁱ	120.0	Au2^ix—Au3—Pd5^x	120.0
Au3—Au2—In4ⁱⁱⁱ	120.0	In4^vi—Au3—Au3^vii	180.0
In4—Au2—In4ⁱⁱⁱ	120.0	Pd1—Au3—Au3^vii	60.0
Pd5ⁱⁱ—Au2—In4ⁱⁱⁱ	60.0	Au2—Au3—Au3^vii	60.0
In4ⁱ—Au2—In4^iv	60.0	In4^vii—Au3—Au3^vii	0.0
Pd5—Au2—In4^iv	60.0	In4^viii—Au3—Au3^vii	120.0
Au3—Au2—In4^iv	60.0	Pd1^ix—Au3—Au3^vii	120.0
In4—Au2—In4^iv	60.0	In4^x—Au3—Au3^vii	60.0
Pd5ⁱⁱ—Au2—In4^iv	120.0	Au3^vi—Au3—Au3^vii	180.0
In4ⁱⁱⁱ—Au2—In4^iv	120.0	Au2^ix—Au3—Au3^vii	120.0
In4ⁱ—Au2—Pd5^v	120.0	Pd5^x—Au3—Au3^vii	60.0
Pd5—Au2—Pd5^v	120.0	In4^vi—Au3—Au3^viii	60.0
Au3—Au2—Pd5^v	120.0	Pd1—Au3—Au3^viii	120.0
In4—Au2—Pd5^v	120.0	Au2—Au3—Au3^viii	120.0
Pd5ⁱⁱ—Au2—Pd5^v	60.0	In4^vii—Au3—Au3^viii	120.0
In4ⁱⁱⁱ—Au2—Pd5^v	60.0	In4^viii—Au3—Au3^viii	0.0
In4^iv—Au2—Pd5^v	180.0	Pd1^ix—Au3—Au3^viii	60.0
In4ⁱ—Au2—In4^v	120.0	In4^x—Au3—Au3^viii	180.0
Pd5—Au2—In4^v	120.0	Au3^vi—Au3—Au3^viii	60.0
Au3—Au2—In4^v	120.0	Au2^ix—Au3—Au3^viii	60.0
In4—Au2—In4^v	120.0	Pd5^x—Au3—Au3^viii	180.0
Pd5ⁱⁱ—Au2—In4^v	60.0	Au3^vii—Au3—Au3^viii	120.0
In4ⁱⁱⁱ—Au2—In4^v	60.0	In4^vi—In4—Pd1	120.0
In4^iv—Au2—In4^v	180.0	In4^vi—In4—Au2	120.0
Pd5^v—Au2—In4^v	0.0	Pd1—In4—Au2	0.0
In4ⁱ—Au2—In4ⁱⁱ	120.0	In4^vi—In4—In4^vii	180.0
Pd5—Au2—In4ⁱⁱ	180.0	Pd1—In4—In4^vii	60.0
Au3—Au2—In4ⁱⁱ	180.0	Au2—In4—In4^vii	60.0
In4—Au2—In4ⁱⁱ	180.0	In4^vi—In4—In4^viii	60.0
Pd5ⁱⁱ—Au2—In4ⁱⁱ	0.0	Pd1—In4—In4^viii	120.0
In4ⁱⁱⁱ—Au2—In4ⁱⁱ	60.0	Au2—In4—In4^viii	120.0
In4^iv—Au2—In4ⁱⁱ	120.0	In4^vii—In4—In4^viii	120.0
Pd5^v—Au2—In4ⁱⁱ	60.0	In4^vi—In4—Pd1^ix	60.0
In4^v—Au2—In4ⁱⁱ	60.0	Pd1—In4—Pd1^ix	180.0
In4ⁱ—Au2—Pd5^iv	60.0	Au2—In4—Pd1^ix	180.0
Pd5—Au2—Pd5^iv	60.0	In4^vii—In4—Pd1^ix	120.0
Au3—Au2—Pd5^iv	60.0	In4^viii—In4—Pd1^ix	60.0
In4—Au2—Pd5^iv	60.0	In4^vi—In4—In4^x	120.0
Pd5ⁱⁱ—Au2—Pd5^iv	120.0	Pd1—In4—In4^x	60.0
In4ⁱⁱⁱ—Au2—Pd5^iv	120.0	Au2—In4—In4^x	60.0
In4^iv—Au2—Pd5^iv	0.0	In4^vii—In4—In4^x	60.0
Pd5^v—Au2—Pd5^iv	180.0	In4^viii—In4—In4^x	180.0
In4^v—Au2—Pd5^iv	180.0	Pd1^ix—In4—In4^x	120.0
In4ⁱⁱ—Au2—Pd5^iv	120.0	In4^vi—In4—Au3^vi	0.0
In4ⁱ—Au2—Pd5ⁱⁱⁱ	180.0	Pd1—In4—Au3^vi	120.0
Pd5—Au2—Pd5ⁱⁱⁱ	120.0	Au2—In4—Au3^vi	120.0
Au3—Au2—Pd5ⁱⁱⁱ	120.0	In4^vii—In4—Au3^vi	180.0
In4—Au2—Pd5ⁱⁱⁱ	120.0	In4^viii—In4—Au3^vi	60.0
Pd5ⁱⁱ—Au2—Pd5ⁱⁱⁱ	60.0	Pd1^ix—In4—Au3^vi	60.0
In4ⁱⁱⁱ—Au2—Pd5ⁱⁱⁱ	0.0	In4^x—In4—Au3^vi	120.0
In4^iv—Au2—Pd5ⁱⁱⁱ	120.0	In4^vi—In4—Au2^ix	60.0
Pd5^v—Au2—Pd5ⁱⁱⁱ	60.0	Pd1—In4—Au2^ix	180.0
In4^v—Au2—Pd5ⁱⁱⁱ	60.0	Au2—In4—Au2^ix	180.0
In4ⁱⁱ—Au2—Pd5ⁱⁱⁱ	60.0	In4^vii—In4—Au2^ix	120.0
Pd5^iv—Au2—Pd5ⁱⁱⁱ	120.0	In4^viii—In4—Au2^ix	60.0
In4^vi—Pd5—Pd1	120.0	Pd1^ix—In4—Au2^ix	0.0
In4^vi—Pd5—Au2	120.0	In4^x—In4—Au2^ix	120.0
Pd1—Pd5—Au2	0.0	Au3^vi—In4—Au2^ix	60.0
In4^vi—Pd5—In4^vii	180.0	In4^vi—In4—Pd5^x	120.0
Pd1—Pd5—In4^vii	60.0	Pd1—In4—Pd5^x	60.0
Au2—Pd5—In4^vii	60.0	Au2—In4—Pd5^x	60.0
In4^vi—Pd5—In4^viii	60.0	In4^vii—In4—Pd5^x	60.0
Pd1—Pd5—In4^viii	120.0	In4^viii—In4—Pd5^x	180.0
Au2—Pd5—In4^viii	120.0	Pd1^ix—In4—Pd5^x	120.0
In4^vii—Pd5—In4^viii	120.0	In4^x—In4—Pd5^x	0.0
In4^vi—Pd5—Pd1^ix	60.0	Au3^vi—In4—Pd5^x	120.0
Pd1—Pd5—Pd1^ix	180.0	Au2^ix—In4—Pd5^x	120.0
Au2—Pd5—Pd1^ix	180.0	In4^vi—In4—Au3^vii	180.0
In4^vii—Pd5—Pd1^ix	120.0	Pd1—In4—Au3^vii	60.0
In4^viii—Pd5—Pd1^ix	60.0	Au2—In4—Au3^vii	60.0
In4^vi—Pd5—In4^x	120.0	In4^vii—In4—Au3^vii	0.0
Pd1—Pd5—In4^x	60.0	In4^viii—In4—Au3^vii	120.0
Au2—Pd5—In4^x	60.0	Pd1^ix—In4—Au3^vii	120.0
In4^vii—Pd5—In4^x	60.0	In4^x—In4—Au3^vii	60.0
In4^viii—Pd5—In4^x	180.0	Au3^vi—In4—Au3^vii	180.0
Pd1^ix—Pd5—In4^x	120.0	Au2^ix—In4—Au3^vii	120.0
In4^vi—Pd5—Au3^vi	0.0	Pd5^x—In4—Au3^vii	60.0
Pd1—Pd5—Au3^vi	120.0	In4^vi—In4—Au3^viii	60.0
Au2—Pd5—Au3^vi	120.0	Pd1—In4—Au3^viii	120.0
In4^vii—Pd5—Au3^vi	180.0	Au2—In4—Au3^viii	120.0
In4^viii—Pd5—Au3^vi	60.0	In4^vii—In4—Au3^viii	120.0
Pd1^ix—Pd5—Au3^vi	60.0	In4^viii—In4—Au3^viii	0.0
In4^x—Pd5—Au3^vi	120.0	Pd1^ix—In4—Au3^viii	60.0
In4^vi—Pd5—Au2^ix	60.0	In4^x—In4—Au3^viii	180.0
Pd1—Pd5—Au2^ix	180.0	Au3^vi—In4—Au3^viii	60.0
Au2—Pd5—Au2^ix	180.0	Au2^ix—In4—Au3^viii	60.0
In4^vii—Pd5—Au2^ix	120.0	Pd5^x—In4—Au3^viii	180.0
In4^viii—Pd5—Au2^ix	60.0	Au3^vii—In4—Au3^viii	120.0

Gold indium dipalladium (2A) top

Crystal data top

Au_1.49In_0.89Pd_1.62	Ag Kα radiation, λ = 0.56087 Å
M_r = 568.20	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 21.0–21.1°
a = 4.0408 (10) Å	µ = 54.65 mm⁻¹
V = 65.98 (5) Å³	T = 295 K
Z = 1	Irregular plate, black
F(000) = 236	0.11 × 0.09 × 0.05 mm
D_x = 14.300 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.053
Radiation source: fine-focus sealed tube	θ_max = 44.5°, θ_min = 4.0°
profile data from ω scans	h = −10→10
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = 0→10
T_min = 0.079, T_max = 0.245	l = 0→10
1263 measured reflections	2 standard reflections every 120 min
148 independent reflections	intensity decay: none
117 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.0128P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.026	(Δ/σ)_max < 0.001
wR(F²) = 0.050	Δρ_max = 2.25 e Å⁻³
S = 0.96	Δρ_min = −2.39 e Å⁻³
148 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.027 (4)

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd1	0.0000	0.0000	0.0000	0.0140 (2)	0.082 (4)
In2	0.0000	0.0000	0.0000	0.0140 (2)	0.888
Au3	0.0000	0.0000	0.0000	0.0140 (2)	0.029 (4)
Pd5	0.0000	0.5000	0.5000	0.01117 (9)	0.5125 (19)
Au4	0.0000	0.5000	0.5000	0.01117 (9)	0.4875 (19)

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd1	0.0140 (2)	0.0140 (2)	0.0140 (2)	0.000	0.000	0.000
In2	0.0140 (2)	0.0140 (2)	0.0140 (2)	0.000	0.000	0.000
Au3	0.0140 (2)	0.0140 (2)	0.0140 (2)	0.000	0.000	0.000
Pd5	0.01058 (13)	0.01146 (11)	0.01146 (11)	0.000	0.000	0.000
Au4	0.01058 (13)	0.01146 (11)	0.01146 (11)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd1—Au4ⁱ	2.8573 (12)	Au3—Pd5ⁱⁱ	2.8573 (12)
Pd1—Pd5	2.8573 (12)	Au3—Au4ⁱⁱⁱ	2.8573 (12)
Pd1—Au4	2.8573 (12)	Au3—Au4^iv	2.8573 (12)
Pd1—Pd5ⁱⁱ	2.8573 (12)	Au3—Pd5^v	2.8573 (12)
Pd1—Au4ⁱⁱⁱ	2.8573 (12)	Au3—Au4^v	2.8573 (12)
Pd1—Au4^iv	2.8573 (12)	Au3—Au4ⁱⁱ	2.8573 (12)
Pd1—Pd5^v	2.8573 (12)	Au3—Pd5^iv	2.8573 (12)
Pd1—Au4^v	2.8573 (12)	Au3—Pd5ⁱⁱⁱ	2.8573 (12)
Pd1—Au4ⁱⁱ	2.8573 (12)	Au3—Pd5ⁱ	2.8573 (12)
Pd1—Pd5^iv	2.8573 (12)	Pd5—Au4^vi	2.8573 (12)
Pd1—Pd5ⁱⁱⁱ	2.8573 (12)	Pd5—Au4^vii	2.8573 (12)
Pd1—Pd5ⁱ	2.8573 (12)	Pd5—Au4^viii	2.8573 (12)
In2—Au4ⁱ	2.8573 (12)	Pd5—Pd1^ix	2.8573 (12)
In2—Pd5	2.8573 (12)	Pd5—Au4^x	2.8573 (12)
In2—Au4	2.8573 (12)	Pd5—Pd5^vi	2.8573 (12)
In2—Pd5ⁱⁱ	2.8573 (12)	Pd5—In2^ix	2.8573 (12)
In2—Au4ⁱⁱⁱ	2.8573 (12)	Pd5—Pd5^vii	2.8573 (12)
In2—Au4^iv	2.8573 (12)	Pd5—Pd5^viii	2.8573 (12)
In2—Pd5^v	2.8573 (12)	Au4—Au4^vi	2.8573 (12)
In2—Au4^v	2.8573 (12)	Au4—Au4^vii	2.8573 (12)
In2—Au4ⁱⁱ	2.8573 (12)	Au4—Au4^viii	2.8573 (12)
In2—Pd5^iv	2.8573 (12)	Au4—Pd1^ix	2.8573 (12)
In2—Pd5ⁱⁱⁱ	2.8573 (12)	Au4—Au4^x	2.8573 (12)
In2—Pd5ⁱ	2.8573 (12)	Au4—Pd5^vi	2.8573 (12)
Au3—Au4ⁱ	2.8573 (12)	Au4—In2^ix	2.8573 (12)
Au3—Pd5	2.8573 (12)	Au4—Pd5^vii	2.8573 (12)
Au3—Au4	2.8573 (12)	Au4—Pd5^viii	2.8573 (12)

Au4ⁱ—Pd1—Pd5	60.0	Au4^iv—Au3—Au4ⁱⁱ	120.0
Au4ⁱ—Pd1—Au4	60.0	Pd5^v—Au3—Au4ⁱⁱ	60.0
Pd5—Pd1—Au4	0.0	Au4^v—Au3—Au4ⁱⁱ	60.0
Au4ⁱ—Pd1—Pd5ⁱⁱ	120.0	Au4ⁱ—Au3—Pd5^iv	60.0
Pd5—Pd1—Pd5ⁱⁱ	180.0	Pd5—Au3—Pd5^iv	60.0
Au4—Pd1—Pd5ⁱⁱ	180.0	Au4—Au3—Pd5^iv	60.0
Au4ⁱ—Pd1—Au4ⁱⁱⁱ	180.0	Pd5ⁱⁱ—Au3—Pd5^iv	120.0
Pd5—Pd1—Au4ⁱⁱⁱ	120.0	Au4ⁱⁱⁱ—Au3—Pd5^iv	120.0
Au4—Pd1—Au4ⁱⁱⁱ	120.0	Au4^iv—Au3—Pd5^iv	0.0
Pd5ⁱⁱ—Pd1—Au4ⁱⁱⁱ	60.0	Pd5^v—Au3—Pd5^iv	180.0
Au4ⁱ—Pd1—Au4^iv	60.0	Au4^v—Au3—Pd5^iv	180.0
Pd5—Pd1—Au4^iv	60.0	Au4ⁱⁱ—Au3—Pd5^iv	120.0
Au4—Pd1—Au4^iv	60.0	Au4ⁱ—Au3—Pd5ⁱⁱⁱ	180.0
Pd5ⁱⁱ—Pd1—Au4^iv	120.0	Pd5—Au3—Pd5ⁱⁱⁱ	120.0
Au4ⁱⁱⁱ—Pd1—Au4^iv	120.0	Au4—Au3—Pd5ⁱⁱⁱ	120.0
Au4ⁱ—Pd1—Pd5^v	120.0	Pd5ⁱⁱ—Au3—Pd5ⁱⁱⁱ	60.0
Pd5—Pd1—Pd5^v	120.0	Au4ⁱⁱⁱ—Au3—Pd5ⁱⁱⁱ	0.0
Au4—Pd1—Pd5^v	120.0	Au4^iv—Au3—Pd5ⁱⁱⁱ	120.0
Pd5ⁱⁱ—Pd1—Pd5^v	60.0	Pd5^v—Au3—Pd5ⁱⁱⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Pd5^v	60.0	Au4^v—Au3—Pd5ⁱⁱⁱ	60.0
Au4^iv—Pd1—Pd5^v	180.0	Au4ⁱⁱ—Au3—Pd5ⁱⁱⁱ	60.0
Au4ⁱ—Pd1—Au4^v	120.0	Pd5^iv—Au3—Pd5ⁱⁱⁱ	120.0
Pd5—Pd1—Au4^v	120.0	Au4ⁱ—Au3—Pd5ⁱ	0.0
Au4—Pd1—Au4^v	120.0	Pd5—Au3—Pd5ⁱ	60.0
Pd5ⁱⁱ—Pd1—Au4^v	60.0	Au4—Au3—Pd5ⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Au4^v	60.0	Pd5ⁱⁱ—Au3—Pd5ⁱ	120.0
Au4^iv—Pd1—Au4^v	180.0	Au4ⁱⁱⁱ—Au3—Pd5ⁱ	180.0
Pd5^v—Pd1—Au4^v	0.0	Au4^iv—Au3—Pd5ⁱ	60.0
Au4ⁱ—Pd1—Au4ⁱⁱ	120.0	Pd5^v—Au3—Pd5ⁱ	120.0
Pd5—Pd1—Au4ⁱⁱ	180.0	Au4^v—Au3—Pd5ⁱ	120.0
Au4—Pd1—Au4ⁱⁱ	180.0	Au4ⁱⁱ—Au3—Pd5ⁱ	120.0
Pd5ⁱⁱ—Pd1—Au4ⁱⁱ	0.0	Pd5^iv—Au3—Pd5ⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Au4ⁱⁱ	60.0	Pd5ⁱⁱⁱ—Au3—Pd5ⁱ	180.0
Au4^iv—Pd1—Au4ⁱⁱ	120.0	Au4^vi—Pd5—Pd1	120.0
Pd5^v—Pd1—Au4ⁱⁱ	60.0	Au4^vi—Pd5—In2	120.0
Au4^v—Pd1—Au4ⁱⁱ	60.0	Pd1—Pd5—In2	0.0
Au4ⁱ—Pd1—Pd5^iv	60.0	Au4^vi—Pd5—Au3	120.0
Pd5—Pd1—Pd5^iv	60.0	Pd1—Pd5—Au3	0.0
Au4—Pd1—Pd5^iv	60.0	In2—Pd5—Au3	0.0
Pd5ⁱⁱ—Pd1—Pd5^iv	120.0	Au4^vi—Pd5—Au4^vii	180.0
Au4ⁱⁱⁱ—Pd1—Pd5^iv	120.0	Pd1—Pd5—Au4^vii	60.0
Au4^iv—Pd1—Pd5^iv	0.0	In2—Pd5—Au4^vii	60.0
Pd5^v—Pd1—Pd5^iv	180.0	Au3—Pd5—Au4^vii	60.0
Au4^v—Pd1—Pd5^iv	180.0	Au4^vi—Pd5—Au4^viii	60.0
Au4ⁱⁱ—Pd1—Pd5^iv	120.0	Pd1—Pd5—Au4^viii	120.0
Au4ⁱ—Pd1—Pd5ⁱⁱⁱ	180.0	In2—Pd5—Au4^viii	120.0
Pd5—Pd1—Pd5ⁱⁱⁱ	120.0	Au3—Pd5—Au4^viii	120.0
Au4—Pd1—Pd5ⁱⁱⁱ	120.0	Au4^vii—Pd5—Au4^viii	120.0
Pd5ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^vi—Pd5—Pd1^ix	60.0
Au4ⁱⁱⁱ—Pd1—Pd5ⁱⁱⁱ	0.0	Pd1—Pd5—Pd1^ix	180.0
Au4^iv—Pd1—Pd5ⁱⁱⁱ	120.0	In2—Pd5—Pd1^ix	180.0
Pd5^v—Pd1—Pd5ⁱⁱⁱ	60.0	Au3—Pd5—Pd1^ix	180.0
Au4^v—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^vii—Pd5—Pd1^ix	120.0
Au4ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^viii—Pd5—Pd1^ix	60.0
Pd5^iv—Pd1—Pd5ⁱⁱⁱ	120.0	Au4^vi—Pd5—Au4^x	120.0
Au4ⁱ—Pd1—Pd5ⁱ	0.0	Pd1—Pd5—Au4^x	60.0
Pd5—Pd1—Pd5ⁱ	60.0	In2—Pd5—Au4^x	60.0
Au4—Pd1—Pd5ⁱ	60.0	Au3—Pd5—Au4^x	60.0
Pd5ⁱⁱ—Pd1—Pd5ⁱ	120.0	Au4^vii—Pd5—Au4^x	60.0
Au4ⁱⁱⁱ—Pd1—Pd5ⁱ	180.0	Au4^viii—Pd5—Au4^x	180.0
Au4^iv—Pd1—Pd5ⁱ	60.0	Pd1^ix—Pd5—Au4^x	120.0
Pd5^v—Pd1—Pd5ⁱ	120.0	Au4^vi—Pd5—Pd5^vi	0.0
Au4^v—Pd1—Pd5ⁱ	120.0	Pd1—Pd5—Pd5^vi	120.0
Au4ⁱⁱ—Pd1—Pd5ⁱ	120.0	In2—Pd5—Pd5^vi	120.0
Pd5^iv—Pd1—Pd5ⁱ	60.0	Au3—Pd5—Pd5^vi	120.0
Pd5ⁱⁱⁱ—Pd1—Pd5ⁱ	180.0	Au4^vii—Pd5—Pd5^vi	180.0
Au4ⁱ—In2—Pd5	60.0	Au4^viii—Pd5—Pd5^vi	60.0
Au4ⁱ—In2—Au4	60.0	Pd1^ix—Pd5—Pd5^vi	60.0
Pd5—In2—Au4	0.0	Au4^x—Pd5—Pd5^vi	120.0
Au4ⁱ—In2—Pd5ⁱⁱ	120.0	Au4^vi—Pd5—In2^ix	60.0
Pd5—In2—Pd5ⁱⁱ	180.0	Pd1—Pd5—In2^ix	180.0
Au4—In2—Pd5ⁱⁱ	180.0	In2—Pd5—In2^ix	180.0
Au4ⁱ—In2—Au4ⁱⁱⁱ	180.0	Au3—Pd5—In2^ix	180.0
Pd5—In2—Au4ⁱⁱⁱ	120.0	Au4^vii—Pd5—In2^ix	120.0
Au4—In2—Au4ⁱⁱⁱ	120.0	Au4^viii—Pd5—In2^ix	60.0
Pd5ⁱⁱ—In2—Au4ⁱⁱⁱ	60.0	Pd1^ix—Pd5—In2^ix	0.0
Au4ⁱ—In2—Au4^iv	60.0	Au4^x—Pd5—In2^ix	120.0
Pd5—In2—Au4^iv	60.0	Pd5^vi—Pd5—In2^ix	60.0
Au4—In2—Au4^iv	60.0	Au4^vi—Pd5—Pd5^vii	180.0
Pd5ⁱⁱ—In2—Au4^iv	120.0	Pd1—Pd5—Pd5^vii	60.0
Au4ⁱⁱⁱ—In2—Au4^iv	120.0	In2—Pd5—Pd5^vii	60.0
Au4ⁱ—In2—Pd5^v	120.0	Au3—Pd5—Pd5^vii	60.0
Pd5—In2—Pd5^v	120.0	Au4^vii—Pd5—Pd5^vii	0.0
Au4—In2—Pd5^v	120.0	Au4^viii—Pd5—Pd5^vii	120.0
Pd5ⁱⁱ—In2—Pd5^v	60.0	Pd1^ix—Pd5—Pd5^vii	120.0
Au4ⁱⁱⁱ—In2—Pd5^v	60.0	Au4^x—Pd5—Pd5^vii	60.0
Au4^iv—In2—Pd5^v	180.0	Pd5^vi—Pd5—Pd5^vii	180.0
Au4ⁱ—In2—Au4^v	120.0	In2^ix—Pd5—Pd5^vii	120.0
Pd5—In2—Au4^v	120.0	Au4^vi—Pd5—Pd5^viii	60.0
Au4—In2—Au4^v	120.0	Pd1—Pd5—Pd5^viii	120.0
Pd5ⁱⁱ—In2—Au4^v	60.0	In2—Pd5—Pd5^viii	120.0
Au4ⁱⁱⁱ—In2—Au4^v	60.0	Au3—Pd5—Pd5^viii	120.0
Au4^iv—In2—Au4^v	180.0	Au4^vii—Pd5—Pd5^viii	120.0
Pd5^v—In2—Au4^v	0.0	Au4^viii—Pd5—Pd5^viii	0.0
Au4ⁱ—In2—Au4ⁱⁱ	120.0	Pd1^ix—Pd5—Pd5^viii	60.0
Pd5—In2—Au4ⁱⁱ	180.0	Au4^x—Pd5—Pd5^viii	180.0
Au4—In2—Au4ⁱⁱ	180.0	Pd5^vi—Pd5—Pd5^viii	60.0
Pd5ⁱⁱ—In2—Au4ⁱⁱ	0.0	In2^ix—Pd5—Pd5^viii	60.0
Au4ⁱⁱⁱ—In2—Au4ⁱⁱ	60.0	Pd5^vii—Pd5—Pd5^viii	120.0
Au4^iv—In2—Au4ⁱⁱ	120.0	Au4^vi—Au4—Pd1	120.0
Pd5^v—In2—Au4ⁱⁱ	60.0	Au4^vi—Au4—In2	120.0
Au4^v—In2—Au4ⁱⁱ	60.0	Pd1—Au4—In2	0.0
Au4ⁱ—In2—Pd5^iv	60.0	Au4^vi—Au4—Au3	120.0
Pd5—In2—Pd5^iv	60.0	Pd1—Au4—Au3	0.0
Au4—In2—Pd5^iv	60.0	In2—Au4—Au3	0.0
Pd5ⁱⁱ—In2—Pd5^iv	120.0	Au4^vi—Au4—Au4^vii	180.0
Au4ⁱⁱⁱ—In2—Pd5^iv	120.0	Pd1—Au4—Au4^vii	60.0
Au4^iv—In2—Pd5^iv	0.0	In2—Au4—Au4^vii	60.0
Pd5^v—In2—Pd5^iv	180.0	Au3—Au4—Au4^vii	60.0
Au4^v—In2—Pd5^iv	180.0	Au4^vi—Au4—Au4^viii	60.0
Au4ⁱⁱ—In2—Pd5^iv	120.0	Pd1—Au4—Au4^viii	120.0
Au4ⁱ—In2—Pd5ⁱⁱⁱ	180.0	In2—Au4—Au4^viii	120.0
Pd5—In2—Pd5ⁱⁱⁱ	120.0	Au3—Au4—Au4^viii	120.0
Au4—In2—Pd5ⁱⁱⁱ	120.0	Au4^vii—Au4—Au4^viii	120.0
Pd5ⁱⁱ—In2—Pd5ⁱⁱⁱ	60.0	Au4^vi—Au4—Pd1^ix	60.0
Au4ⁱⁱⁱ—In2—Pd5ⁱⁱⁱ	0.0	Pd1—Au4—Pd1^ix	180.0
Au4^iv—In2—Pd5ⁱⁱⁱ	120.0	In2—Au4—Pd1^ix	180.0
Pd5^v—In2—Pd5ⁱⁱⁱ	60.0	Au3—Au4—Pd1^ix	180.0
Au4^v—In2—Pd5ⁱⁱⁱ	60.0	Au4^vii—Au4—Pd1^ix	120.0
Au4ⁱⁱ—In2—Pd5ⁱⁱⁱ	60.0	Au4^viii—Au4—Pd1^ix	60.0
Pd5^iv—In2—Pd5ⁱⁱⁱ	120.0	Au4^vi—Au4—Au4^x	120.0
Au4ⁱ—In2—Pd5ⁱ	0.0	Pd1—Au4—Au4^x	60.0
Pd5—In2—Pd5ⁱ	60.0	In2—Au4—Au4^x	60.0
Au4—In2—Pd5ⁱ	60.0	Au3—Au4—Au4^x	60.0
Pd5ⁱⁱ—In2—Pd5ⁱ	120.0	Au4^vii—Au4—Au4^x	60.0
Au4ⁱⁱⁱ—In2—Pd5ⁱ	180.0	Au4^viii—Au4—Au4^x	180.0
Au4^iv—In2—Pd5ⁱ	60.0	Pd1^ix—Au4—Au4^x	120.0
Pd5^v—In2—Pd5ⁱ	120.0	Au4^vi—Au4—Pd5^vi	0.0
Au4^v—In2—Pd5ⁱ	120.0	Pd1—Au4—Pd5^vi	120.0
Au4ⁱⁱ—In2—Pd5ⁱ	120.0	In2—Au4—Pd5^vi	120.0
Pd5^iv—In2—Pd5ⁱ	60.0	Au3—Au4—Pd5^vi	120.0
Pd5ⁱⁱⁱ—In2—Pd5ⁱ	180.0	Au4^vii—Au4—Pd5^vi	180.0
Au4ⁱ—Au3—Pd5	60.0	Au4^viii—Au4—Pd5^vi	60.0
Au4ⁱ—Au3—Au4	60.0	Pd1^ix—Au4—Pd5^vi	60.0
Pd5—Au3—Au4	0.0	Au4^x—Au4—Pd5^vi	120.0
Au4ⁱ—Au3—Pd5ⁱⁱ	120.0	Au4^vi—Au4—In2^ix	60.0
Pd5—Au3—Pd5ⁱⁱ	180.0	Pd1—Au4—In2^ix	180.0
Au4—Au3—Pd5ⁱⁱ	180.0	In2—Au4—In2^ix	180.0
Au4ⁱ—Au3—Au4ⁱⁱⁱ	180.0	Au3—Au4—In2^ix	180.0
Pd5—Au3—Au4ⁱⁱⁱ	120.0	Au4^vii—Au4—In2^ix	120.0
Au4—Au3—Au4ⁱⁱⁱ	120.0	Au4^viii—Au4—In2^ix	60.0
Pd5ⁱⁱ—Au3—Au4ⁱⁱⁱ	60.0	Pd1^ix—Au4—In2^ix	0.0
Au4ⁱ—Au3—Au4^iv	60.0	Au4^x—Au4—In2^ix	120.0
Pd5—Au3—Au4^iv	60.0	Pd5^vi—Au4—In2^ix	60.0
Au4—Au3—Au4^iv	60.0	Au4^vi—Au4—Pd5^vii	180.0
Pd5ⁱⁱ—Au3—Au4^iv	120.0	Pd1—Au4—Pd5^vii	60.0
Au4ⁱⁱⁱ—Au3—Au4^iv	120.0	In2—Au4—Pd5^vii	60.0
Au4ⁱ—Au3—Pd5^v	120.0	Au3—Au4—Pd5^vii	60.0
Pd5—Au3—Pd5^v	120.0	Au4^vii—Au4—Pd5^vii	0.0
Au4—Au3—Pd5^v	120.0	Au4^viii—Au4—Pd5^vii	120.0
Pd5ⁱⁱ—Au3—Pd5^v	60.0	Pd1^ix—Au4—Pd5^vii	120.0
Au4ⁱⁱⁱ—Au3—Pd5^v	60.0	Au4^x—Au4—Pd5^vii	60.0
Au4^iv—Au3—Pd5^v	180.0	Pd5^vi—Au4—Pd5^vii	180.0
Au4ⁱ—Au3—Au4^v	120.0	In2^ix—Au4—Pd5^vii	120.0
Pd5—Au3—Au4^v	120.0	Au4^vi—Au4—Pd5^viii	60.0
Au4—Au3—Au4^v	120.0	Pd1—Au4—Pd5^viii	120.0
Pd5ⁱⁱ—Au3—Au4^v	60.0	In2—Au4—Pd5^viii	120.0
Au4ⁱⁱⁱ—Au3—Au4^v	60.0	Au3—Au4—Pd5^viii	120.0
Au4^iv—Au3—Au4^v	180.0	Au4^vii—Au4—Pd5^viii	120.0
Pd5^v—Au3—Au4^v	0.0	Au4^viii—Au4—Pd5^viii	0.0
Au4ⁱ—Au3—Au4ⁱⁱ	120.0	Pd1^ix—Au4—Pd5^viii	60.0
Pd5—Au3—Au4ⁱⁱ	180.0	Au4^x—Au4—Pd5^viii	180.0
Au4—Au3—Au4ⁱⁱ	180.0	Pd5^vi—Au4—Pd5^viii	60.0
Pd5ⁱⁱ—Au3—Au4ⁱⁱ	0.0	In2^ix—Au4—Pd5^viii	60.0
Au4ⁱⁱⁱ—Au3—Au4ⁱⁱ	60.0	Pd5^vii—Au4—Pd5^viii	120.0

Gold indium dipalladium (2B) top

Crystal data top

Au_1.49In_0.89Pd_1.62	Ag Kα radiation, λ = 0.56087 Å
M_r = 568.20	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 21.0–21.1°
a = 4.0408 (10) Å	µ = 54.65 mm⁻¹
V = 65.98 (5) Å³	T = 295 K
Z = 1	Irregular plate, black
F(000) = 236	0.11 × 0.09 × 0.05 mm
D_x = 14.300 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.053
Radiation source: fine-focus sealed tube	θ_max = 44.5°, θ_min = 4.0°
profile data from ω scans	h = −10→10
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = 0→10
T_min = 0.079, T_max = 0.245	l = 0→10
1263 measured reflections	2 standard reflections every 120 min
148 independent reflections	intensity decay: none
117 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.0128P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.025	(Δ/σ)_max < 0.001
wR(F²) = 0.050	Δρ_max = 2.34 e Å⁻³
S = 0.96	Δρ_min = −2.41 e Å⁻³
148 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.028 (4)

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd1	0.0000	0.0000	0.0000	0.0141 (2)	0.881 (4)
Au2	0.0000	0.0000	0.0000	0.0141 (2)	0.119 (4)
Pd4	0.0000	0.5000	0.5000	0.01119 (9)	0.2464 (19)
Au3	0.0000	0.5000	0.5000	0.01119 (9)	0.4576 (19)
In5	0.0000	0.5000	0.5000	0.01119 (9)	0.296

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd1	0.0141 (2)	0.0141 (2)	0.0141 (2)	0.000	0.000	0.000
Au2	0.0141 (2)	0.0141 (2)	0.0141 (2)	0.000	0.000	0.000
Pd4	0.01062 (13)	0.01148 (10)	0.01148 (10)	0.000	0.000	0.000
Au3	0.01062 (13)	0.01148 (10)	0.01148 (10)	0.000	0.000	0.000
In5	0.01062 (13)	0.01148 (10)	0.01148 (10)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd1—In5ⁱ	2.8573 (12)	Pd4—Pd1^ix	2.8573 (12)
Pd1—Pd4	2.8573 (12)	Pd4—In5^x	2.8573 (12)
Pd1—Au3	2.8573 (12)	Pd4—Au3^vi	2.8573 (12)
Pd1—In5	2.8573 (12)	Pd4—Au2^ix	2.8573 (12)
Pd1—Pd4ⁱⁱ	2.8573 (12)	Pd4—Pd4^x	2.8573 (12)
Pd1—In5ⁱⁱⁱ	2.8573 (12)	Pd4—Au3^vii	2.8573 (12)
Pd1—In5^iv	2.8573 (12)	Pd4—Au3^viii	2.8573 (12)
Pd1—Pd4^v	2.8573 (12)	Au3—In5^vi	2.8573 (12)
Pd1—In5^v	2.8573 (12)	Au3—In5^vii	2.8573 (12)
Pd1—In5ⁱⁱ	2.8573 (12)	Au3—In5^viii	2.8573 (12)
Pd1—Pd4^iv	2.8573 (12)	Au3—Pd1^ix	2.8573 (12)
Pd1—Pd4ⁱⁱⁱ	2.8573 (12)	Au3—In5^x	2.8573 (12)
Au2—In5ⁱ	2.8573 (12)	Au3—Au3^vi	2.8573 (12)
Au2—Pd4	2.8573 (12)	Au3—Au2^ix	2.8573 (12)
Au2—Au3	2.8573 (12)	Au3—Pd4^x	2.8573 (12)
Au2—In5	2.8573 (12)	Au3—Au3^vii	2.8573 (12)
Au2—Pd4ⁱⁱ	2.8573 (12)	Au3—Au3^viii	2.8573 (12)
Au2—In5ⁱⁱⁱ	2.8573 (12)	In5—In5^vi	2.8573 (12)
Au2—In5^iv	2.8573 (12)	In5—In5^vii	2.8573 (12)
Au2—Pd4^v	2.8573 (12)	In5—In5^viii	2.8573 (12)
Au2—In5^v	2.8573 (12)	In5—Pd1^ix	2.8573 (12)
Au2—In5ⁱⁱ	2.8573 (12)	In5—In5^x	2.8573 (12)
Au2—Pd4^iv	2.8573 (12)	In5—Au3^vi	2.8573 (12)
Au2—Pd4ⁱⁱⁱ	2.8573 (12)	In5—Au2^ix	2.8573 (12)
Pd4—In5^vi	2.8573 (12)	In5—Pd4^x	2.8573 (12)
Pd4—In5^vii	2.8573 (12)	In5—Au3^vii	2.8573 (12)
Pd4—In5^viii	2.8573 (12)	In5—Au3^viii	2.8573 (12)

In5ⁱ—Pd1—Pd4	60.0	Pd1^ix—Pd4—Au2^ix	0.0
In5ⁱ—Pd1—Au3	60.0	In5^x—Pd4—Au2^ix	120.0
Pd4—Pd1—Au3	0.0	Au3^vi—Pd4—Au2^ix	60.0
In5ⁱ—Pd1—In5	60.0	In5^vi—Pd4—Pd4^x	120.0
Pd4—Pd1—In5	0.0	Pd1—Pd4—Pd4^x	60.0
Au3—Pd1—In5	0.0	Au2—Pd4—Pd4^x	60.0
In5ⁱ—Pd1—Pd4ⁱⁱ	120.0	In5^vii—Pd4—Pd4^x	60.0
Pd4—Pd1—Pd4ⁱⁱ	180.0	In5^viii—Pd4—Pd4^x	180.0
Au3—Pd1—Pd4ⁱⁱ	180.0	Pd1^ix—Pd4—Pd4^x	120.0
In5—Pd1—Pd4ⁱⁱ	180.0	In5^x—Pd4—Pd4^x	0.0
In5ⁱ—Pd1—In5ⁱⁱⁱ	180.0	Au3^vi—Pd4—Pd4^x	120.0
Pd4—Pd1—In5ⁱⁱⁱ	120.0	Au2^ix—Pd4—Pd4^x	120.0
Au3—Pd1—In5ⁱⁱⁱ	120.0	In5^vi—Pd4—Au3^vii	180.0
In5—Pd1—In5ⁱⁱⁱ	120.0	Pd1—Pd4—Au3^vii	60.0
Pd4ⁱⁱ—Pd1—In5ⁱⁱⁱ	60.0	Au2—Pd4—Au3^vii	60.0
In5ⁱ—Pd1—In5^iv	60.0	In5^vii—Pd4—Au3^vii	0.0
Pd4—Pd1—In5^iv	60.0	In5^viii—Pd4—Au3^vii	120.0
Au3—Pd1—In5^iv	60.0	Pd1^ix—Pd4—Au3^vii	120.0
In5—Pd1—In5^iv	60.0	In5^x—Pd4—Au3^vii	60.0
Pd4ⁱⁱ—Pd1—In5^iv	120.0	Au3^vi—Pd4—Au3^vii	180.0
In5ⁱⁱⁱ—Pd1—In5^iv	120.0	Au2^ix—Pd4—Au3^vii	120.0
In5ⁱ—Pd1—Pd4^v	120.0	Pd4^x—Pd4—Au3^vii	60.0
Pd4—Pd1—Pd4^v	120.0	In5^vi—Pd4—Au3^viii	60.0
Au3—Pd1—Pd4^v	120.0	Pd1—Pd4—Au3^viii	120.0
In5—Pd1—Pd4^v	120.0	Au2—Pd4—Au3^viii	120.0
Pd4ⁱⁱ—Pd1—Pd4^v	60.0	In5^vii—Pd4—Au3^viii	120.0
In5ⁱⁱⁱ—Pd1—Pd4^v	60.0	In5^viii—Pd4—Au3^viii	0.0
In5^iv—Pd1—Pd4^v	180.0	Pd1^ix—Pd4—Au3^viii	60.0
In5ⁱ—Pd1—In5^v	120.0	In5^x—Pd4—Au3^viii	180.0
Pd4—Pd1—In5^v	120.0	Au3^vi—Pd4—Au3^viii	60.0
Au3—Pd1—In5^v	120.0	Au2^ix—Pd4—Au3^viii	60.0
In5—Pd1—In5^v	120.0	Pd4^x—Pd4—Au3^viii	180.0
Pd4ⁱⁱ—Pd1—In5^v	60.0	Au3^vii—Pd4—Au3^viii	120.0
In5ⁱⁱⁱ—Pd1—In5^v	60.0	In5^vi—Au3—Pd1	120.0
In5^iv—Pd1—In5^v	180.0	In5^vi—Au3—Au2	120.0
Pd4^v—Pd1—In5^v	0.0	Pd1—Au3—Au2	0.0
In5ⁱ—Pd1—In5ⁱⁱ	120.0	In5^vi—Au3—In5^vii	180.0
Pd4—Pd1—In5ⁱⁱ	180.0	Pd1—Au3—In5^vii	60.0
Au3—Pd1—In5ⁱⁱ	180.0	Au2—Au3—In5^vii	60.0
In5—Pd1—In5ⁱⁱ	180.0	In5^vi—Au3—In5^viii	60.0
Pd4ⁱⁱ—Pd1—In5ⁱⁱ	0.0	Pd1—Au3—In5^viii	120.0
In5ⁱⁱⁱ—Pd1—In5ⁱⁱ	60.0	Au2—Au3—In5^viii	120.0
In5^iv—Pd1—In5ⁱⁱ	120.0	In5^vii—Au3—In5^viii	120.0
Pd4^v—Pd1—In5ⁱⁱ	60.0	In5^vi—Au3—Pd1^ix	60.0
In5^v—Pd1—In5ⁱⁱ	60.0	Pd1—Au3—Pd1^ix	180.0
In5ⁱ—Pd1—Pd4^iv	60.0	Au2—Au3—Pd1^ix	180.0
Pd4—Pd1—Pd4^iv	60.0	In5^vii—Au3—Pd1^ix	120.0
Au3—Pd1—Pd4^iv	60.0	In5^viii—Au3—Pd1^ix	60.0
In5—Pd1—Pd4^iv	60.0	In5^vi—Au3—In5^x	120.0
Pd4ⁱⁱ—Pd1—Pd4^iv	120.0	Pd1—Au3—In5^x	60.0
In5ⁱⁱⁱ—Pd1—Pd4^iv	120.0	Au2—Au3—In5^x	60.0
In5^iv—Pd1—Pd4^iv	0.0	In5^vii—Au3—In5^x	60.0
Pd4^v—Pd1—Pd4^iv	180.0	In5^viii—Au3—In5^x	180.0
In5^v—Pd1—Pd4^iv	180.0	Pd1^ix—Au3—In5^x	120.0
In5ⁱⁱ—Pd1—Pd4^iv	120.0	In5^vi—Au3—Au3^vi	0.0
In5ⁱ—Pd1—Pd4ⁱⁱⁱ	180.0	Pd1—Au3—Au3^vi	120.0
Pd4—Pd1—Pd4ⁱⁱⁱ	120.0	Au2—Au3—Au3^vi	120.0
Au3—Pd1—Pd4ⁱⁱⁱ	120.0	In5^vii—Au3—Au3^vi	180.0
In5—Pd1—Pd4ⁱⁱⁱ	120.0	In5^viii—Au3—Au3^vi	60.0
Pd4ⁱⁱ—Pd1—Pd4ⁱⁱⁱ	60.0	Pd1^ix—Au3—Au3^vi	60.0
In5ⁱⁱⁱ—Pd1—Pd4ⁱⁱⁱ	0.0	In5^x—Au3—Au3^vi	120.0
In5^iv—Pd1—Pd4ⁱⁱⁱ	120.0	In5^vi—Au3—Au2^ix	60.0
Pd4^v—Pd1—Pd4ⁱⁱⁱ	60.0	Pd1—Au3—Au2^ix	180.0
In5^v—Pd1—Pd4ⁱⁱⁱ	60.0	Au2—Au3—Au2^ix	180.0
In5ⁱⁱ—Pd1—Pd4ⁱⁱⁱ	60.0	In5^vii—Au3—Au2^ix	120.0
Pd4^iv—Pd1—Pd4ⁱⁱⁱ	120.0	In5^viii—Au3—Au2^ix	60.0
In5ⁱ—Au2—Pd4	60.0	Pd1^ix—Au3—Au2^ix	0.0
In5ⁱ—Au2—Au3	60.0	In5^x—Au3—Au2^ix	120.0
Pd4—Au2—Au3	0.0	Au3^vi—Au3—Au2^ix	60.0
In5ⁱ—Au2—In5	60.0	In5^vi—Au3—Pd4^x	120.0
Pd4—Au2—In5	0.0	Pd1—Au3—Pd4^x	60.0
Au3—Au2—In5	0.0	Au2—Au3—Pd4^x	60.0
In5ⁱ—Au2—Pd4ⁱⁱ	120.0	In5^vii—Au3—Pd4^x	60.0
Pd4—Au2—Pd4ⁱⁱ	180.0	In5^viii—Au3—Pd4^x	180.0
Au3—Au2—Pd4ⁱⁱ	180.0	Pd1^ix—Au3—Pd4^x	120.0
In5—Au2—Pd4ⁱⁱ	180.0	In5^x—Au3—Pd4^x	0.0
In5ⁱ—Au2—In5ⁱⁱⁱ	180.0	Au3^vi—Au3—Pd4^x	120.0
Pd4—Au2—In5ⁱⁱⁱ	120.0	Au2^ix—Au3—Pd4^x	120.0
Au3—Au2—In5ⁱⁱⁱ	120.0	In5^vi—Au3—Au3^vii	180.0
In5—Au2—In5ⁱⁱⁱ	120.0	Pd1—Au3—Au3^vii	60.0
Pd4ⁱⁱ—Au2—In5ⁱⁱⁱ	60.0	Au2—Au3—Au3^vii	60.0
In5ⁱ—Au2—In5^iv	60.0	In5^vii—Au3—Au3^vii	0.0
Pd4—Au2—In5^iv	60.0	In5^viii—Au3—Au3^vii	120.0
Au3—Au2—In5^iv	60.0	Pd1^ix—Au3—Au3^vii	120.0
In5—Au2—In5^iv	60.0	In5^x—Au3—Au3^vii	60.0
Pd4ⁱⁱ—Au2—In5^iv	120.0	Au3^vi—Au3—Au3^vii	180.0
In5ⁱⁱⁱ—Au2—In5^iv	120.0	Au2^ix—Au3—Au3^vii	120.0
In5ⁱ—Au2—Pd4^v	120.0	Pd4^x—Au3—Au3^vii	60.0
Pd4—Au2—Pd4^v	120.0	In5^vi—Au3—Au3^viii	60.0
Au3—Au2—Pd4^v	120.0	Pd1—Au3—Au3^viii	120.0
In5—Au2—Pd4^v	120.0	Au2—Au3—Au3^viii	120.0
Pd4ⁱⁱ—Au2—Pd4^v	60.0	In5^vii—Au3—Au3^viii	120.0
In5ⁱⁱⁱ—Au2—Pd4^v	60.0	In5^viii—Au3—Au3^viii	0.0
In5^iv—Au2—Pd4^v	180.0	Pd1^ix—Au3—Au3^viii	60.0
In5ⁱ—Au2—In5^v	120.0	In5^x—Au3—Au3^viii	180.0
Pd4—Au2—In5^v	120.0	Au3^vi—Au3—Au3^viii	60.0
Au3—Au2—In5^v	120.0	Au2^ix—Au3—Au3^viii	60.0
In5—Au2—In5^v	120.0	Pd4^x—Au3—Au3^viii	180.0
Pd4ⁱⁱ—Au2—In5^v	60.0	Au3^vii—Au3—Au3^viii	120.0
In5ⁱⁱⁱ—Au2—In5^v	60.0	In5^vi—In5—Pd1	120.0
In5^iv—Au2—In5^v	180.0	In5^vi—In5—Au2	120.0
Pd4^v—Au2—In5^v	0.0	Pd1—In5—Au2	0.0
In5ⁱ—Au2—In5ⁱⁱ	120.0	In5^vi—In5—In5^vii	180.0
Pd4—Au2—In5ⁱⁱ	180.0	Pd1—In5—In5^vii	60.0
Au3—Au2—In5ⁱⁱ	180.0	Au2—In5—In5^vii	60.0
In5—Au2—In5ⁱⁱ	180.0	In5^vi—In5—In5^viii	60.0
Pd4ⁱⁱ—Au2—In5ⁱⁱ	0.0	Pd1—In5—In5^viii	120.0
In5ⁱⁱⁱ—Au2—In5ⁱⁱ	60.0	Au2—In5—In5^viii	120.0
In5^iv—Au2—In5ⁱⁱ	120.0	In5^vii—In5—In5^viii	120.0
Pd4^v—Au2—In5ⁱⁱ	60.0	In5^vi—In5—Pd1^ix	60.0
In5^v—Au2—In5ⁱⁱ	60.0	Pd1—In5—Pd1^ix	180.0
In5ⁱ—Au2—Pd4^iv	60.0	Au2—In5—Pd1^ix	180.0
Pd4—Au2—Pd4^iv	60.0	In5^vii—In5—Pd1^ix	120.0
Au3—Au2—Pd4^iv	60.0	In5^viii—In5—Pd1^ix	60.0
In5—Au2—Pd4^iv	60.0	In5^vi—In5—In5^x	120.0
Pd4ⁱⁱ—Au2—Pd4^iv	120.0	Pd1—In5—In5^x	60.0
In5ⁱⁱⁱ—Au2—Pd4^iv	120.0	Au2—In5—In5^x	60.0
In5^iv—Au2—Pd4^iv	0.0	In5^vii—In5—In5^x	60.0
Pd4^v—Au2—Pd4^iv	180.0	In5^viii—In5—In5^x	180.0
In5^v—Au2—Pd4^iv	180.0	Pd1^ix—In5—In5^x	120.0
In5ⁱⁱ—Au2—Pd4^iv	120.0	In5^vi—In5—Au3^vi	0.0
In5ⁱ—Au2—Pd4ⁱⁱⁱ	180.0	Pd1—In5—Au3^vi	120.0
Pd4—Au2—Pd4ⁱⁱⁱ	120.0	Au2—In5—Au3^vi	120.0
Au3—Au2—Pd4ⁱⁱⁱ	120.0	In5^vii—In5—Au3^vi	180.0
In5—Au2—Pd4ⁱⁱⁱ	120.0	In5^viii—In5—Au3^vi	60.0
Pd4ⁱⁱ—Au2—Pd4ⁱⁱⁱ	60.0	Pd1^ix—In5—Au3^vi	60.0
In5ⁱⁱⁱ—Au2—Pd4ⁱⁱⁱ	0.0	In5^x—In5—Au3^vi	120.0
In5^iv—Au2—Pd4ⁱⁱⁱ	120.0	In5^vi—In5—Au2^ix	60.0
Pd4^v—Au2—Pd4ⁱⁱⁱ	60.0	Pd1—In5—Au2^ix	180.0
In5^v—Au2—Pd4ⁱⁱⁱ	60.0	Au2—In5—Au2^ix	180.0
In5ⁱⁱ—Au2—Pd4ⁱⁱⁱ	60.0	In5^vii—In5—Au2^ix	120.0
Pd4^iv—Au2—Pd4ⁱⁱⁱ	120.0	In5^viii—In5—Au2^ix	60.0
In5^vi—Pd4—Pd1	120.0	Pd1^ix—In5—Au2^ix	0.0
In5^vi—Pd4—Au2	120.0	In5^x—In5—Au2^ix	120.0
Pd1—Pd4—Au2	0.0	Au3^vi—In5—Au2^ix	60.0
In5^vi—Pd4—In5^vii	180.0	In5^vi—In5—Pd4^x	120.0
Pd1—Pd4—In5^vii	60.0	Pd1—In5—Pd4^x	60.0
Au2—Pd4—In5^vii	60.0	Au2—In5—Pd4^x	60.0
In5^vi—Pd4—In5^viii	60.0	In5^vii—In5—Pd4^x	60.0
Pd1—Pd4—In5^viii	120.0	In5^viii—In5—Pd4^x	180.0
Au2—Pd4—In5^viii	120.0	Pd1^ix—In5—Pd4^x	120.0
In5^vii—Pd4—In5^viii	120.0	In5^x—In5—Pd4^x	0.0
In5^vi—Pd4—Pd1^ix	60.0	Au3^vi—In5—Pd4^x	120.0
Pd1—Pd4—Pd1^ix	180.0	Au2^ix—In5—Pd4^x	120.0
Au2—Pd4—Pd1^ix	180.0	In5^vi—In5—Au3^vii	180.0
In5^vii—Pd4—Pd1^ix	120.0	Pd1—In5—Au3^vii	60.0
In5^viii—Pd4—Pd1^ix	60.0	Au2—In5—Au3^vii	60.0
In5^vi—Pd4—In5^x	120.0	In5^vii—In5—Au3^vii	0.0
Pd1—Pd4—In5^x	60.0	In5^viii—In5—Au3^vii	120.0
Au2—Pd4—In5^x	60.0	Pd1^ix—In5—Au3^vii	120.0
In5^vii—Pd4—In5^x	60.0	In5^x—In5—Au3^vii	60.0
In5^viii—Pd4—In5^x	180.0	Au3^vi—In5—Au3^vii	180.0
Pd1^ix—Pd4—In5^x	120.0	Au2^ix—In5—Au3^vii	120.0
In5^vi—Pd4—Au3^vi	0.0	Pd4^x—In5—Au3^vii	60.0
Pd1—Pd4—Au3^vi	120.0	In5^vi—In5—Au3^viii	60.0
Au2—Pd4—Au3^vi	120.0	Pd1—In5—Au3^viii	120.0
In5^vii—Pd4—Au3^vi	180.0	Au2—In5—Au3^viii	120.0
In5^viii—Pd4—Au3^vi	60.0	In5^vii—In5—Au3^viii	120.0
Pd1^ix—Pd4—Au3^vi	60.0	In5^viii—In5—Au3^viii	0.0
In5^x—Pd4—Au3^vi	120.0	Pd1^ix—In5—Au3^viii	60.0
In5^vi—Pd4—Au2^ix	60.0	In5^x—In5—Au3^viii	180.0
Pd1—Pd4—Au2^ix	180.0	Au3^vi—In5—Au3^viii	60.0
Au2—Pd4—Au2^ix	180.0	Au2^ix—In5—Au3^viii	60.0
In5^vii—Pd4—Au2^ix	120.0	Pd4^x—In5—Au3^viii	180.0
In5^viii—Pd4—Au2^ix	60.0	Au3^vii—In5—Au3^viii	120.0

Digold indium palladium (3A) top

Crystal data top

Au_1.77In_0.86Pd_1.37	Ag Kα radiation, λ = 0.56087 Å
M_r = 592.96	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 21.0–21.1°
a = 4.0538 (10) Å	µ = 61.39 mm⁻¹
V = 66.62 (5) Å³	T = 295 K
Z = 1	Irregular block, black
F(000) = 245	0.10 × 0.09 × 0.08 mm
D_x = 14.781 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.067
Radiation source: fine-focus sealed tube	θ_max = 44.9°, θ_min = 4.0°
profile data from ω scans	h = 0→10
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = −10→10
T_min = 0.052, T_max = 0.188	l = 0→10
1283 measured reflections	2 standard reflections every 120 min
150 independent reflections	intensity decay: none
113 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.019P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.023	(Δ/σ)_max < 0.001
wR(F²) = 0.061	Δρ_max = 2.51 e Å⁻³
S = 1.04	Δρ_min = −3.29 e Å⁻³
150 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.011 (4)

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd1	0.0000	0.0000	0.0000	0.0124 (3)	0.067 (7)
In2	0.0000	0.0000	0.0000	0.0124 (3)	0.8602
Au3	0.0000	0.0000	0.0000	0.0124 (3)	0.072 (7)
Pd5	0.0000	0.5000	0.5000	0.00987 (10)	0.435 (3)
Au4	0.0000	0.5000	0.5000	0.00987 (10)	0.565 (3)

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd1	0.0124 (3)	0.0124 (3)	0.0124 (3)	0.000	0.000	0.000
In2	0.0124 (3)	0.0124 (3)	0.0124 (3)	0.000	0.000	0.000
Au3	0.0124 (3)	0.0124 (3)	0.0124 (3)	0.000	0.000	0.000
Pd5	0.00940 (16)	0.01010 (12)	0.01010 (12)	0.000	0.000	0.000
Au4	0.00940 (16)	0.01010 (12)	0.01010 (12)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd1—Au4ⁱ	2.8665 (12)	Au3—Pd5ⁱⁱ	2.8665 (12)
Pd1—Pd5	2.8665 (12)	Au3—Au4ⁱⁱⁱ	2.8665 (12)
Pd1—Au4	2.8665 (12)	Au3—Au4^iv	2.8665 (12)
Pd1—Pd5ⁱⁱ	2.8665 (12)	Au3—Pd5^v	2.8665 (12)
Pd1—Au4ⁱⁱⁱ	2.8665 (12)	Au3—Au4^v	2.8665 (12)
Pd1—Au4^iv	2.8665 (12)	Au3—Au4ⁱⁱ	2.8665 (12)
Pd1—Pd5^v	2.8665 (12)	Au3—Pd5^iv	2.8665 (12)
Pd1—Au4^v	2.8665 (12)	Au3—Pd5ⁱⁱⁱ	2.8665 (12)
Pd1—Au4ⁱⁱ	2.8665 (12)	Au3—Pd5ⁱ	2.8665 (12)
Pd1—Pd5^iv	2.8665 (12)	Pd5—Au4^vi	2.8665 (12)
Pd1—Pd5ⁱⁱⁱ	2.8665 (12)	Pd5—Au4^vii	2.8665 (12)
Pd1—Pd5ⁱ	2.8665 (12)	Pd5—Au4^viii	2.8665 (12)
In2—Au4ⁱ	2.8665 (12)	Pd5—Pd1^ix	2.8665 (12)
In2—Pd5	2.8665 (12)	Pd5—Au4^x	2.8665 (12)
In2—Au4	2.8665 (12)	Pd5—Pd5^vi	2.8665 (12)
In2—Pd5ⁱⁱ	2.8665 (12)	Pd5—In2^ix	2.8665 (12)
In2—Au4ⁱⁱⁱ	2.8665 (12)	Pd5—Pd5^vii	2.8665 (12)
In2—Au4^iv	2.8665 (12)	Pd5—Pd5^viii	2.8665 (12)
In2—Pd5^v	2.8665 (12)	Au4—Au4^vi	2.8665 (12)
In2—Au4^v	2.8665 (12)	Au4—Au4^vii	2.8665 (12)
In2—Au4ⁱⁱ	2.8665 (12)	Au4—Au4^viii	2.8665 (12)
In2—Pd5^iv	2.8665 (12)	Au4—Pd1^ix	2.8665 (12)
In2—Pd5ⁱⁱⁱ	2.8665 (12)	Au4—Au4^x	2.8665 (12)
In2—Pd5ⁱ	2.8665 (12)	Au4—Pd5^vi	2.8665 (12)
Au3—Au4ⁱ	2.8665 (12)	Au4—In2^ix	2.8665 (12)
Au3—Pd5	2.8665 (12)	Au4—Pd5^vii	2.8665 (12)
Au3—Au4	2.8665 (12)	Au4—Pd5^viii	2.8665 (12)

Au4ⁱ—Pd1—Pd5	60.0	Au4^iv—Au3—Au4ⁱⁱ	120.0
Au4ⁱ—Pd1—Au4	60.0	Pd5^v—Au3—Au4ⁱⁱ	60.0
Pd5—Pd1—Au4	0.0	Au4^v—Au3—Au4ⁱⁱ	60.0
Au4ⁱ—Pd1—Pd5ⁱⁱ	120.0	Au4ⁱ—Au3—Pd5^iv	60.0
Pd5—Pd1—Pd5ⁱⁱ	180.0	Pd5—Au3—Pd5^iv	60.0
Au4—Pd1—Pd5ⁱⁱ	180.0	Au4—Au3—Pd5^iv	60.0
Au4ⁱ—Pd1—Au4ⁱⁱⁱ	180.0	Pd5ⁱⁱ—Au3—Pd5^iv	120.0
Pd5—Pd1—Au4ⁱⁱⁱ	120.0	Au4ⁱⁱⁱ—Au3—Pd5^iv	120.0
Au4—Pd1—Au4ⁱⁱⁱ	120.0	Au4^iv—Au3—Pd5^iv	0.0
Pd5ⁱⁱ—Pd1—Au4ⁱⁱⁱ	60.0	Pd5^v—Au3—Pd5^iv	180.0
Au4ⁱ—Pd1—Au4^iv	60.0	Au4^v—Au3—Pd5^iv	180.0
Pd5—Pd1—Au4^iv	60.0	Au4ⁱⁱ—Au3—Pd5^iv	120.0
Au4—Pd1—Au4^iv	60.0	Au4ⁱ—Au3—Pd5ⁱⁱⁱ	180.0
Pd5ⁱⁱ—Pd1—Au4^iv	120.0	Pd5—Au3—Pd5ⁱⁱⁱ	120.0
Au4ⁱⁱⁱ—Pd1—Au4^iv	120.0	Au4—Au3—Pd5ⁱⁱⁱ	120.0
Au4ⁱ—Pd1—Pd5^v	120.0	Pd5ⁱⁱ—Au3—Pd5ⁱⁱⁱ	60.0
Pd5—Pd1—Pd5^v	120.0	Au4ⁱⁱⁱ—Au3—Pd5ⁱⁱⁱ	0.0
Au4—Pd1—Pd5^v	120.0	Au4^iv—Au3—Pd5ⁱⁱⁱ	120.0
Pd5ⁱⁱ—Pd1—Pd5^v	60.0	Pd5^v—Au3—Pd5ⁱⁱⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Pd5^v	60.0	Au4^v—Au3—Pd5ⁱⁱⁱ	60.0
Au4^iv—Pd1—Pd5^v	180.0	Au4ⁱⁱ—Au3—Pd5ⁱⁱⁱ	60.0
Au4ⁱ—Pd1—Au4^v	120.0	Pd5^iv—Au3—Pd5ⁱⁱⁱ	120.0
Pd5—Pd1—Au4^v	120.0	Au4ⁱ—Au3—Pd5ⁱ	0.0
Au4—Pd1—Au4^v	120.0	Pd5—Au3—Pd5ⁱ	60.0
Pd5ⁱⁱ—Pd1—Au4^v	60.0	Au4—Au3—Pd5ⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Au4^v	60.0	Pd5ⁱⁱ—Au3—Pd5ⁱ	120.0
Au4^iv—Pd1—Au4^v	180.0	Au4ⁱⁱⁱ—Au3—Pd5ⁱ	180.0
Pd5^v—Pd1—Au4^v	0.0	Au4^iv—Au3—Pd5ⁱ	60.0
Au4ⁱ—Pd1—Au4ⁱⁱ	120.0	Pd5^v—Au3—Pd5ⁱ	120.0
Pd5—Pd1—Au4ⁱⁱ	180.0	Au4^v—Au3—Pd5ⁱ	120.0
Au4—Pd1—Au4ⁱⁱ	180.0	Au4ⁱⁱ—Au3—Pd5ⁱ	120.0
Pd5ⁱⁱ—Pd1—Au4ⁱⁱ	0.0	Pd5^iv—Au3—Pd5ⁱ	60.0
Au4ⁱⁱⁱ—Pd1—Au4ⁱⁱ	60.0	Pd5ⁱⁱⁱ—Au3—Pd5ⁱ	180.0
Au4^iv—Pd1—Au4ⁱⁱ	120.0	Au4^vi—Pd5—Pd1	120.0
Pd5^v—Pd1—Au4ⁱⁱ	60.0	Au4^vi—Pd5—In2	120.0
Au4^v—Pd1—Au4ⁱⁱ	60.0	Pd1—Pd5—In2	0.0
Au4ⁱ—Pd1—Pd5^iv	60.0	Au4^vi—Pd5—Au3	120.0
Pd5—Pd1—Pd5^iv	60.0	Pd1—Pd5—Au3	0.0
Au4—Pd1—Pd5^iv	60.0	In2—Pd5—Au3	0.0
Pd5ⁱⁱ—Pd1—Pd5^iv	120.0	Au4^vi—Pd5—Au4^vii	180.0
Au4ⁱⁱⁱ—Pd1—Pd5^iv	120.0	Pd1—Pd5—Au4^vii	60.0
Au4^iv—Pd1—Pd5^iv	0.0	In2—Pd5—Au4^vii	60.0
Pd5^v—Pd1—Pd5^iv	180.0	Au3—Pd5—Au4^vii	60.0
Au4^v—Pd1—Pd5^iv	180.0	Au4^vi—Pd5—Au4^viii	60.0
Au4ⁱⁱ—Pd1—Pd5^iv	120.0	Pd1—Pd5—Au4^viii	120.0
Au4ⁱ—Pd1—Pd5ⁱⁱⁱ	180.0	In2—Pd5—Au4^viii	120.0
Pd5—Pd1—Pd5ⁱⁱⁱ	120.0	Au3—Pd5—Au4^viii	120.0
Au4—Pd1—Pd5ⁱⁱⁱ	120.0	Au4^vii—Pd5—Au4^viii	120.0
Pd5ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^vi—Pd5—Pd1^ix	60.0
Au4ⁱⁱⁱ—Pd1—Pd5ⁱⁱⁱ	0.0	Pd1—Pd5—Pd1^ix	180.0
Au4^iv—Pd1—Pd5ⁱⁱⁱ	120.0	In2—Pd5—Pd1^ix	180.0
Pd5^v—Pd1—Pd5ⁱⁱⁱ	60.0	Au3—Pd5—Pd1^ix	180.0
Au4^v—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^vii—Pd5—Pd1^ix	120.0
Au4ⁱⁱ—Pd1—Pd5ⁱⁱⁱ	60.0	Au4^viii—Pd5—Pd1^ix	60.0
Pd5^iv—Pd1—Pd5ⁱⁱⁱ	120.0	Au4^vi—Pd5—Au4^x	120.0
Au4ⁱ—Pd1—Pd5ⁱ	0.0	Pd1—Pd5—Au4^x	60.0
Pd5—Pd1—Pd5ⁱ	60.0	In2—Pd5—Au4^x	60.0
Au4—Pd1—Pd5ⁱ	60.0	Au3—Pd5—Au4^x	60.0
Pd5ⁱⁱ—Pd1—Pd5ⁱ	120.0	Au4^vii—Pd5—Au4^x	60.0
Au4ⁱⁱⁱ—Pd1—Pd5ⁱ	180.0	Au4^viii—Pd5—Au4^x	180.0
Au4^iv—Pd1—Pd5ⁱ	60.0	Pd1^ix—Pd5—Au4^x	120.0
Pd5^v—Pd1—Pd5ⁱ	120.0	Au4^vi—Pd5—Pd5^vi	0.0
Au4^v—Pd1—Pd5ⁱ	120.0	Pd1—Pd5—Pd5^vi	120.0
Au4ⁱⁱ—Pd1—Pd5ⁱ	120.0	In2—Pd5—Pd5^vi	120.0
Pd5^iv—Pd1—Pd5ⁱ	60.0	Au3—Pd5—Pd5^vi	120.0
Pd5ⁱⁱⁱ—Pd1—Pd5ⁱ	180.0	Au4^vii—Pd5—Pd5^vi	180.0
Au4ⁱ—In2—Pd5	60.0	Au4^viii—Pd5—Pd5^vi	60.0
Au4ⁱ—In2—Au4	60.0	Pd1^ix—Pd5—Pd5^vi	60.0
Pd5—In2—Au4	0.0	Au4^x—Pd5—Pd5^vi	120.0
Au4ⁱ—In2—Pd5ⁱⁱ	120.0	Au4^vi—Pd5—In2^ix	60.0
Pd5—In2—Pd5ⁱⁱ	180.0	Pd1—Pd5—In2^ix	180.0
Au4—In2—Pd5ⁱⁱ	180.0	In2—Pd5—In2^ix	180.0
Au4ⁱ—In2—Au4ⁱⁱⁱ	180.0	Au3—Pd5—In2^ix	180.0
Pd5—In2—Au4ⁱⁱⁱ	120.0	Au4^vii—Pd5—In2^ix	120.0
Au4—In2—Au4ⁱⁱⁱ	120.0	Au4^viii—Pd5—In2^ix	60.0
Pd5ⁱⁱ—In2—Au4ⁱⁱⁱ	60.0	Pd1^ix—Pd5—In2^ix	0.0
Au4ⁱ—In2—Au4^iv	60.0	Au4^x—Pd5—In2^ix	120.0
Pd5—In2—Au4^iv	60.0	Pd5^vi—Pd5—In2^ix	60.0
Au4—In2—Au4^iv	60.0	Au4^vi—Pd5—Pd5^vii	180.0
Pd5ⁱⁱ—In2—Au4^iv	120.0	Pd1—Pd5—Pd5^vii	60.0
Au4ⁱⁱⁱ—In2—Au4^iv	120.0	In2—Pd5—Pd5^vii	60.0
Au4ⁱ—In2—Pd5^v	120.0	Au3—Pd5—Pd5^vii	60.0
Pd5—In2—Pd5^v	120.0	Au4^vii—Pd5—Pd5^vii	0.0
Au4—In2—Pd5^v	120.0	Au4^viii—Pd5—Pd5^vii	120.0
Pd5ⁱⁱ—In2—Pd5^v	60.0	Pd1^ix—Pd5—Pd5^vii	120.0
Au4ⁱⁱⁱ—In2—Pd5^v	60.0	Au4^x—Pd5—Pd5^vii	60.0
Au4^iv—In2—Pd5^v	180.0	Pd5^vi—Pd5—Pd5^vii	180.0
Au4ⁱ—In2—Au4^v	120.0	In2^ix—Pd5—Pd5^vii	120.0
Pd5—In2—Au4^v	120.0	Au4^vi—Pd5—Pd5^viii	60.0
Au4—In2—Au4^v	120.0	Pd1—Pd5—Pd5^viii	120.0
Pd5ⁱⁱ—In2—Au4^v	60.0	In2—Pd5—Pd5^viii	120.0
Au4ⁱⁱⁱ—In2—Au4^v	60.0	Au3—Pd5—Pd5^viii	120.0
Au4^iv—In2—Au4^v	180.0	Au4^vii—Pd5—Pd5^viii	120.0
Pd5^v—In2—Au4^v	0.0	Au4^viii—Pd5—Pd5^viii	0.0
Au4ⁱ—In2—Au4ⁱⁱ	120.0	Pd1^ix—Pd5—Pd5^viii	60.0
Pd5—In2—Au4ⁱⁱ	180.0	Au4^x—Pd5—Pd5^viii	180.0
Au4—In2—Au4ⁱⁱ	180.0	Pd5^vi—Pd5—Pd5^viii	60.0
Pd5ⁱⁱ—In2—Au4ⁱⁱ	0.0	In2^ix—Pd5—Pd5^viii	60.0
Au4ⁱⁱⁱ—In2—Au4ⁱⁱ	60.0	Pd5^vii—Pd5—Pd5^viii	120.0
Au4^iv—In2—Au4ⁱⁱ	120.0	Au4^vi—Au4—Pd1	120.0
Pd5^v—In2—Au4ⁱⁱ	60.0	Au4^vi—Au4—In2	120.0
Au4^v—In2—Au4ⁱⁱ	60.0	Pd1—Au4—In2	0.0
Au4ⁱ—In2—Pd5^iv	60.0	Au4^vi—Au4—Au3	120.0
Pd5—In2—Pd5^iv	60.0	Pd1—Au4—Au3	0.0
Au4—In2—Pd5^iv	60.0	In2—Au4—Au3	0.0
Pd5ⁱⁱ—In2—Pd5^iv	120.0	Au4^vi—Au4—Au4^vii	180.0
Au4ⁱⁱⁱ—In2—Pd5^iv	120.0	Pd1—Au4—Au4^vii	60.0
Au4^iv—In2—Pd5^iv	0.0	In2—Au4—Au4^vii	60.0
Pd5^v—In2—Pd5^iv	180.0	Au3—Au4—Au4^vii	60.0
Au4^v—In2—Pd5^iv	180.0	Au4^vi—Au4—Au4^viii	60.0
Au4ⁱⁱ—In2—Pd5^iv	120.0	Pd1—Au4—Au4^viii	120.0
Au4ⁱ—In2—Pd5ⁱⁱⁱ	180.0	In2—Au4—Au4^viii	120.0
Pd5—In2—Pd5ⁱⁱⁱ	120.0	Au3—Au4—Au4^viii	120.0
Au4—In2—Pd5ⁱⁱⁱ	120.0	Au4^vii—Au4—Au4^viii	120.0
Pd5ⁱⁱ—In2—Pd5ⁱⁱⁱ	60.0	Au4^vi—Au4—Pd1^ix	60.0
Au4ⁱⁱⁱ—In2—Pd5ⁱⁱⁱ	0.0	Pd1—Au4—Pd1^ix	180.0
Au4^iv—In2—Pd5ⁱⁱⁱ	120.0	In2—Au4—Pd1^ix	180.0
Pd5^v—In2—Pd5ⁱⁱⁱ	60.0	Au3—Au4—Pd1^ix	180.0
Au4^v—In2—Pd5ⁱⁱⁱ	60.0	Au4^vii—Au4—Pd1^ix	120.0
Au4ⁱⁱ—In2—Pd5ⁱⁱⁱ	60.0	Au4^viii—Au4—Pd1^ix	60.0
Pd5^iv—In2—Pd5ⁱⁱⁱ	120.0	Au4^vi—Au4—Au4^x	120.0
Au4ⁱ—In2—Pd5ⁱ	0.0	Pd1—Au4—Au4^x	60.0
Pd5—In2—Pd5ⁱ	60.0	In2—Au4—Au4^x	60.0
Au4—In2—Pd5ⁱ	60.0	Au3—Au4—Au4^x	60.0
Pd5ⁱⁱ—In2—Pd5ⁱ	120.0	Au4^vii—Au4—Au4^x	60.0
Au4ⁱⁱⁱ—In2—Pd5ⁱ	180.0	Au4^viii—Au4—Au4^x	180.0
Au4^iv—In2—Pd5ⁱ	60.0	Pd1^ix—Au4—Au4^x	120.0
Pd5^v—In2—Pd5ⁱ	120.0	Au4^vi—Au4—Pd5^vi	0.0
Au4^v—In2—Pd5ⁱ	120.0	Pd1—Au4—Pd5^vi	120.0
Au4ⁱⁱ—In2—Pd5ⁱ	120.0	In2—Au4—Pd5^vi	120.0
Pd5^iv—In2—Pd5ⁱ	60.0	Au3—Au4—Pd5^vi	120.0
Pd5ⁱⁱⁱ—In2—Pd5ⁱ	180.0	Au4^vii—Au4—Pd5^vi	180.0
Au4ⁱ—Au3—Pd5	60.0	Au4^viii—Au4—Pd5^vi	60.0
Au4ⁱ—Au3—Au4	60.0	Pd1^ix—Au4—Pd5^vi	60.0
Pd5—Au3—Au4	0.0	Au4^x—Au4—Pd5^vi	120.0
Au4ⁱ—Au3—Pd5ⁱⁱ	120.0	Au4^vi—Au4—In2^ix	60.0
Pd5—Au3—Pd5ⁱⁱ	180.0	Pd1—Au4—In2^ix	180.0
Au4—Au3—Pd5ⁱⁱ	180.0	In2—Au4—In2^ix	180.0
Au4ⁱ—Au3—Au4ⁱⁱⁱ	180.0	Au3—Au4—In2^ix	180.0
Pd5—Au3—Au4ⁱⁱⁱ	120.0	Au4^vii—Au4—In2^ix	120.0
Au4—Au3—Au4ⁱⁱⁱ	120.0	Au4^viii—Au4—In2^ix	60.0
Pd5ⁱⁱ—Au3—Au4ⁱⁱⁱ	60.0	Pd1^ix—Au4—In2^ix	0.0
Au4ⁱ—Au3—Au4^iv	60.0	Au4^x—Au4—In2^ix	120.0
Pd5—Au3—Au4^iv	60.0	Pd5^vi—Au4—In2^ix	60.0
Au4—Au3—Au4^iv	60.0	Au4^vi—Au4—Pd5^vii	180.0
Pd5ⁱⁱ—Au3—Au4^iv	120.0	Pd1—Au4—Pd5^vii	60.0
Au4ⁱⁱⁱ—Au3—Au4^iv	120.0	In2—Au4—Pd5^vii	60.0
Au4ⁱ—Au3—Pd5^v	120.0	Au3—Au4—Pd5^vii	60.0
Pd5—Au3—Pd5^v	120.0	Au4^vii—Au4—Pd5^vii	0.0
Au4—Au3—Pd5^v	120.0	Au4^viii—Au4—Pd5^vii	120.0
Pd5ⁱⁱ—Au3—Pd5^v	60.0	Pd1^ix—Au4—Pd5^vii	120.0
Au4ⁱⁱⁱ—Au3—Pd5^v	60.0	Au4^x—Au4—Pd5^vii	60.0
Au4^iv—Au3—Pd5^v	180.0	Pd5^vi—Au4—Pd5^vii	180.0
Au4ⁱ—Au3—Au4^v	120.0	In2^ix—Au4—Pd5^vii	120.0
Pd5—Au3—Au4^v	120.0	Au4^vi—Au4—Pd5^viii	60.0
Au4—Au3—Au4^v	120.0	Pd1—Au4—Pd5^viii	120.0
Pd5ⁱⁱ—Au3—Au4^v	60.0	In2—Au4—Pd5^viii	120.0
Au4ⁱⁱⁱ—Au3—Au4^v	60.0	Au3—Au4—Pd5^viii	120.0
Au4^iv—Au3—Au4^v	180.0	Au4^vii—Au4—Pd5^viii	120.0
Pd5^v—Au3—Au4^v	0.0	Au4^viii—Au4—Pd5^viii	0.0
Au4ⁱ—Au3—Au4ⁱⁱ	120.0	Pd1^ix—Au4—Pd5^viii	60.0
Pd5—Au3—Au4ⁱⁱ	180.0	Au4^x—Au4—Pd5^viii	180.0
Au4—Au3—Au4ⁱⁱ	180.0	Pd5^vi—Au4—Pd5^viii	60.0
Pd5ⁱⁱ—Au3—Au4ⁱⁱ	0.0	In2^ix—Au4—Pd5^viii	60.0
Au4ⁱⁱⁱ—Au3—Au4ⁱⁱ	60.0	Pd5^vii—Au4—Pd5^viii	120.0

Digold indium palladium (3B) top

Crystal data top

Au_1.77In_0.86Pd_1.37	Ag Kα radiation, λ = 0.56087 Å
M_r = 592.96	Cell parameters from 24 reflections
Cubic, Pm3m	θ = 21.0–21.1°
a = 4.0538 (10) Å	µ = 61.39 mm⁻¹
V = 66.62 (5) Å³	T = 295 K
Z = 1	Irregular block, black
F(000) = 245	0.10 × 0.09 × 0.08 mm
D_x = 14.781 Mg m⁻³

Data collection top

Nonius CAD-4 diffractometer	R_int = 0.067
Radiation source: fine-focus sealed tube	θ_max = 44.9°, θ_min = 4.0°
profile data from ω scans	h = 0→10
Absorption correction: empirical (using intensity measurements) [ψ scan (North et al., 1968) followed by multiscan (Blessing, 1995)]	k = −10→10
T_min = 0.052, T_max = 0.188	l = 0→10
1283 measured reflections	2 standard reflections every 120 min
150 independent reflections	intensity decay: none
113 reflections with I > 2σ(I)

Refinement top

Refinement on F²	1 restraint
Least-squares matrix: full	w = 1/[σ²(F_o²) + (0.0185P)²] where P = (F_o² + 2F_c²)/3
R[F² > 2σ(F²)] = 0.022	(Δ/σ)_max < 0.001
wR(F²) = 0.061	Δρ_max = 2.55 e Å⁻³
S = 1.04	Δρ_min = −3.44 e Å⁻³
150 reflections	Extinction correction: SHELXL2014 (Sheldrick, 2015), Fc^*=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4
7 parameters	Extinction coefficient: 0.011 (4)

Special details top

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å²) top

	x	y	z	U_iso*/U_eq	Occ. (<1)
Pd1	0.0000	0.0000	0.0000	0.0124 (3)	0.843 (7)
Au2	0.0000	0.0000	0.0000	0.0124 (3)	0.157 (7)
Pd4	0.0000	0.5000	0.5000	0.00990 (10)	0.176 (3)
Au3	0.0000	0.5000	0.5000	0.00990 (10)	0.537 (3)
In5	0.0000	0.5000	0.5000	0.00990 (10)	0.2867

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Pd1	0.0124 (3)	0.0124 (3)	0.0124 (3)	0.000	0.000	0.000
Au2	0.0124 (3)	0.0124 (3)	0.0124 (3)	0.000	0.000	0.000
Pd4	0.00944 (15)	0.01013 (12)	0.01013 (12)	0.000	0.000	0.000
Au3	0.00944 (15)	0.01013 (12)	0.01013 (12)	0.000	0.000	0.000
In5	0.00944 (15)	0.01013 (12)	0.01013 (12)	0.000	0.000	0.000

Geometric parameters (Å, º) top

Pd1—In5ⁱ	2.8665 (7)	Pd4—Pd1^ix	2.8665 (7)
Pd1—Pd4	2.8665 (7)	Pd4—In5^x	2.8665 (7)
Pd1—Au3	2.8665 (7)	Pd4—Au3^vi	2.8665 (7)
Pd1—In5	2.8665 (7)	Pd4—Au2^ix	2.8665 (7)
Pd1—Pd4ⁱⁱ	2.8665 (7)	Pd4—Pd4^x	2.8665 (7)
Pd1—In5ⁱⁱⁱ	2.8665 (7)	Pd4—Au3^vii	2.8665 (7)
Pd1—In5^iv	2.8665 (7)	Pd4—Au3^viii	2.8665 (7)
Pd1—Pd4^v	2.8665 (7)	Au3—In5^vi	2.8665 (7)
Pd1—In5^v	2.8665 (7)	Au3—In5^vii	2.8665 (7)
Pd1—In5ⁱⁱ	2.8665 (7)	Au3—In5^viii	2.8665 (7)
Pd1—Pd4^iv	2.8665 (7)	Au3—Pd1^ix	2.8665 (7)
Pd1—Pd4ⁱⁱⁱ	2.8665 (7)	Au3—In5^x	2.8665 (7)
Au2—In5ⁱ	2.8665 (7)	Au3—Au3^vi	2.8665 (7)
Au2—Pd4	2.8665 (7)	Au3—Au2^ix	2.8665 (7)
Au2—Au3	2.8665 (7)	Au3—Pd4^x	2.8665 (7)
Au2—In5	2.8665 (7)	Au3—Au3^vii	2.8665 (7)
Au2—Pd4ⁱⁱ	2.8665 (7)	Au3—Au3^viii	2.8665 (7)
Au2—In5ⁱⁱⁱ	2.8665 (7)	In5—In5^vi	2.8665 (7)
Au2—In5^iv	2.8665 (7)	In5—In5^vii	2.8665 (7)
Au2—Pd4^v	2.8665 (7)	In5—In5^viii	2.8665 (7)
Au2—In5^v	2.8665 (7)	In5—Pd1^ix	2.8665 (7)
Au2—In5ⁱⁱ	2.8665 (7)	In5—In5^x	2.8665 (7)
Au2—Pd4^iv	2.8665 (7)	In5—Au3^vi	2.8665 (7)
Au2—Pd4ⁱⁱⁱ	2.8665 (7)	In5—Au2^ix	2.8665 (7)
Pd4—In5^vi	2.8665 (7)	In5—Pd4^x	2.8665 (7)
Pd4—In5^vii	2.8665 (7)	In5—Au3^vii	2.8665 (7)
Pd4—In5^viii	2.8665 (7)	In5—Au3^viii	2.8665 (7)

In5ⁱ—Pd1—Pd4	60.0	Pd1^ix—Pd4—Au2^ix	0.0
In5ⁱ—Pd1—Au3	60.0	In5^x—Pd4—Au2^ix	120.0
Pd4—Pd1—Au3	0.0	Au3^vi—Pd4—Au2^ix	60.0
In5ⁱ—Pd1—In5	60.0	In5^vi—Pd4—Pd4^x	120.0
Pd4—Pd1—In5	0.0	Pd1—Pd4—Pd4^x	60.0
Au3—Pd1—In5	0.0	Au2—Pd4—Pd4^x	60.0
In5ⁱ—Pd1—Pd4ⁱⁱ	120.0	In5^vii—Pd4—Pd4^x	60.0
Pd4—Pd1—Pd4ⁱⁱ	180.0	In5^viii—Pd4—Pd4^x	180.0
Au3—Pd1—Pd4ⁱⁱ	180.0	Pd1^ix—Pd4—Pd4^x	120.0
In5—Pd1—Pd4ⁱⁱ	180.0	In5^x—Pd4—Pd4^x	0.0
In5ⁱ—Pd1—In5ⁱⁱⁱ	180.0	Au3^vi—Pd4—Pd4^x	120.0
Pd4—Pd1—In5ⁱⁱⁱ	120.0	Au2^ix—Pd4—Pd4^x	120.0
Au3—Pd1—In5ⁱⁱⁱ	120.0	In5^vi—Pd4—Au3^vii	180.0
In5—Pd1—In5ⁱⁱⁱ	120.0	Pd1—Pd4—Au3^vii	60.0
Pd4ⁱⁱ—Pd1—In5ⁱⁱⁱ	60.0	Au2—Pd4—Au3^vii	60.0
In5ⁱ—Pd1—In5^iv	60.0	In5^vii—Pd4—Au3^vii	0.0
Pd4—Pd1—In5^iv	60.0	In5^viii—Pd4—Au3^vii	120.0
Au3—Pd1—In5^iv	60.0	Pd1^ix—Pd4—Au3^vii	120.0
In5—Pd1—In5^iv	60.0	In5^x—Pd4—Au3^vii	60.0
Pd4ⁱⁱ—Pd1—In5^iv	120.0	Au3^vi—Pd4—Au3^vii	180.0
In5ⁱⁱⁱ—Pd1—In5^iv	120.0	Au2^ix—Pd4—Au3^vii	120.0
In5ⁱ—Pd1—Pd4^v	120.0	Pd4^x—Pd4—Au3^vii	60.0
Pd4—Pd1—Pd4^v	120.0	In5^vi—Pd4—Au3^viii	60.0
Au3—Pd1—Pd4^v	120.0	Pd1—Pd4—Au3^viii	120.0
In5—Pd1—Pd4^v	120.0	Au2—Pd4—Au3^viii	120.0
Pd4ⁱⁱ—Pd1—Pd4^v	60.0	In5^vii—Pd4—Au3^viii	120.0
In5ⁱⁱⁱ—Pd1—Pd4^v	60.0	In5^viii—Pd4—Au3^viii	0.0
In5^iv—Pd1—Pd4^v	180.0	Pd1^ix—Pd4—Au3^viii	60.0
In5ⁱ—Pd1—In5^v	120.0	In5^x—Pd4—Au3^viii	180.0
Pd4—Pd1—In5^v	120.0	Au3^vi—Pd4—Au3^viii	60.0
Au3—Pd1—In5^v	120.0	Au2^ix—Pd4—Au3^viii	60.0
In5—Pd1—In5^v	120.0	Pd4^x—Pd4—Au3^viii	180.0
Pd4ⁱⁱ—Pd1—In5^v	60.0	Au3^vii—Pd4—Au3^viii	120.0
In5ⁱⁱⁱ—Pd1—In5^v	60.0	In5^vi—Au3—Pd1	120.0
In5^iv—Pd1—In5^v	180.0	In5^vi—Au3—Au2	120.0
Pd4^v—Pd1—In5^v	0.0	Pd1—Au3—Au2	0.0
In5ⁱ—Pd1—In5ⁱⁱ	120.0	In5^vi—Au3—In5^vii	180.0
Pd4—Pd1—In5ⁱⁱ	180.0	Pd1—Au3—In5^vii	60.0
Au3—Pd1—In5ⁱⁱ	180.0	Au2—Au3—In5^vii	60.0
In5—Pd1—In5ⁱⁱ	180.0	In5^vi—Au3—In5^viii	60.0
Pd4ⁱⁱ—Pd1—In5ⁱⁱ	0.0	Pd1—Au3—In5^viii	120.0
In5ⁱⁱⁱ—Pd1—In5ⁱⁱ	60.0	Au2—Au3—In5^viii	120.0
In5^iv—Pd1—In5ⁱⁱ	120.0	In5^vii—Au3—In5^viii	120.0
Pd4^v—Pd1—In5ⁱⁱ	60.0	In5^vi—Au3—Pd1^ix	60.0
In5^v—Pd1—In5ⁱⁱ	60.0	Pd1—Au3—Pd1^ix	180.0
In5ⁱ—Pd1—Pd4^iv	60.0	Au2—Au3—Pd1^ix	180.0
Pd4—Pd1—Pd4^iv	60.0	In5^vii—Au3—Pd1^ix	120.0
Au3—Pd1—Pd4^iv	60.0	In5^viii—Au3—Pd1^ix	60.0
In5—Pd1—Pd4^iv	60.0	In5^vi—Au3—In5^x	120.0
Pd4ⁱⁱ—Pd1—Pd4^iv	120.0	Pd1—Au3—In5^x	60.0
In5ⁱⁱⁱ—Pd1—Pd4^iv	120.0	Au2—Au3—In5^x	60.0
In5^iv—Pd1—Pd4^iv	0.0	In5^vii—Au3—In5^x	60.0
Pd4^v—Pd1—Pd4^iv	180.0	In5^viii—Au3—In5^x	180.0
In5^v—Pd1—Pd4^iv	180.0	Pd1^ix—Au3—In5^x	120.0
In5ⁱⁱ—Pd1—Pd4^iv	120.0	In5^vi—Au3—Au3^vi	0.0
In5ⁱ—Pd1—Pd4ⁱⁱⁱ	180.0	Pd1—Au3—Au3^vi	120.0
Pd4—Pd1—Pd4ⁱⁱⁱ	120.0	Au2—Au3—Au3^vi	120.0
Au3—Pd1—Pd4ⁱⁱⁱ	120.0	In5^vii—Au3—Au3^vi	180.0
In5—Pd1—Pd4ⁱⁱⁱ	120.0	In5^viii—Au3—Au3^vi	60.0
Pd4ⁱⁱ—Pd1—Pd4ⁱⁱⁱ	60.0	Pd1^ix—Au3—Au3^vi	60.0
In5ⁱⁱⁱ—Pd1—Pd4ⁱⁱⁱ	0.0	In5^x—Au3—Au3^vi	120.0
In5^iv—Pd1—Pd4ⁱⁱⁱ	120.0	In5^vi—Au3—Au2^ix	60.0
Pd4^v—Pd1—Pd4ⁱⁱⁱ	60.0	Pd1—Au3—Au2^ix	180.0
In5^v—Pd1—Pd4ⁱⁱⁱ	60.0	Au2—Au3—Au2^ix	180.0
In5ⁱⁱ—Pd1—Pd4ⁱⁱⁱ	60.0	In5^vii—Au3—Au2^ix	120.0
Pd4^iv—Pd1—Pd4ⁱⁱⁱ	120.0	In5^viii—Au3—Au2^ix	60.0
In5ⁱ—Au2—Pd4	60.0	Pd1^ix—Au3—Au2^ix	0.0
In5ⁱ—Au2—Au3	60.0	In5^x—Au3—Au2^ix	120.0
Pd4—Au2—Au3	0.0	Au3^vi—Au3—Au2^ix	60.0
In5ⁱ—Au2—In5	60.0	In5^vi—Au3—Pd4^x	120.0
Pd4—Au2—In5	0.0	Pd1—Au3—Pd4^x	60.0
Au3—Au2—In5	0.0	Au2—Au3—Pd4^x	60.0
In5ⁱ—Au2—Pd4ⁱⁱ	120.0	In5^vii—Au3—Pd4^x	60.0
Pd4—Au2—Pd4ⁱⁱ	180.0	In5^viii—Au3—Pd4^x	180.0
Au3—Au2—Pd4ⁱⁱ	180.0	Pd1^ix—Au3—Pd4^x	120.0
In5—Au2—Pd4ⁱⁱ	180.0	In5^x—Au3—Pd4^x	0.0
In5ⁱ—Au2—In5ⁱⁱⁱ	180.0	Au3^vi—Au3—Pd4^x	120.0
Pd4—Au2—In5ⁱⁱⁱ	120.0	Au2^ix—Au3—Pd4^x	120.0
Au3—Au2—In5ⁱⁱⁱ	120.0	In5^vi—Au3—Au3^vii	180.0
In5—Au2—In5ⁱⁱⁱ	120.0	Pd1—Au3—Au3^vii	60.0
Pd4ⁱⁱ—Au2—In5ⁱⁱⁱ	60.0	Au2—Au3—Au3^vii	60.0
In5ⁱ—Au2—In5^iv	60.0	In5^vii—Au3—Au3^vii	0.0
Pd4—Au2—In5^iv	60.0	In5^viii—Au3—Au3^vii	120.0
Au3—Au2—In5^iv	60.0	Pd1^ix—Au3—Au3^vii	120.0
In5—Au2—In5^iv	60.0	In5^x—Au3—Au3^vii	60.0
Pd4ⁱⁱ—Au2—In5^iv	120.0	Au3^vi—Au3—Au3^vii	180.0
In5ⁱⁱⁱ—Au2—In5^iv	120.0	Au2^ix—Au3—Au3^vii	120.0
In5ⁱ—Au2—Pd4^v	120.0	Pd4^x—Au3—Au3^vii	60.0
Pd4—Au2—Pd4^v	120.0	In5^vi—Au3—Au3^viii	60.0
Au3—Au2—Pd4^v	120.0	Pd1—Au3—Au3^viii	120.0
In5—Au2—Pd4^v	120.0	Au2—Au3—Au3^viii	120.0
Pd4ⁱⁱ—Au2—Pd4^v	60.0	In5^vii—Au3—Au3^viii	120.0
In5ⁱⁱⁱ—Au2—Pd4^v	60.0	In5^viii—Au3—Au3^viii	0.0
In5^iv—Au2—Pd4^v	180.0	Pd1^ix—Au3—Au3^viii	60.0
In5ⁱ—Au2—In5^v	120.0	In5^x—Au3—Au3^viii	180.0
Pd4—Au2—In5^v	120.0	Au3^vi—Au3—Au3^viii	60.0
Au3—Au2—In5^v	120.0	Au2^ix—Au3—Au3^viii	60.0
In5—Au2—In5^v	120.0	Pd4^x—Au3—Au3^viii	180.0
Pd4ⁱⁱ—Au2—In5^v	60.0	Au3^vii—Au3—Au3^viii	120.0
In5ⁱⁱⁱ—Au2—In5^v	60.0	In5^vi—In5—Pd1	120.0
In5^iv—Au2—In5^v	180.0	In5^vi—In5—Au2	120.0
Pd4^v—Au2—In5^v	0.0	Pd1—In5—Au2	0.0
In5ⁱ—Au2—In5ⁱⁱ	120.0	In5^vi—In5—In5^vii	180.0
Pd4—Au2—In5ⁱⁱ	180.0	Pd1—In5—In5^vii	60.0
Au3—Au2—In5ⁱⁱ	180.0	Au2—In5—In5^vii	60.0
In5—Au2—In5ⁱⁱ	180.0	In5^vi—In5—In5^viii	60.0
Pd4ⁱⁱ—Au2—In5ⁱⁱ	0.0	Pd1—In5—In5^viii	120.0
In5ⁱⁱⁱ—Au2—In5ⁱⁱ	60.0	Au2—In5—In5^viii	120.0
In5^iv—Au2—In5ⁱⁱ	120.0	In5^vii—In5—In5^viii	120.0
Pd4^v—Au2—In5ⁱⁱ	60.0	In5^vi—In5—Pd1^ix	60.0
In5^v—Au2—In5ⁱⁱ	60.0	Pd1—In5—Pd1^ix	180.0
In5ⁱ—Au2—Pd4^iv	60.0	Au2—In5—Pd1^ix	180.0
Pd4—Au2—Pd4^iv	60.0	In5^vii—In5—Pd1^ix	120.0
Au3—Au2—Pd4^iv	60.0	In5^viii—In5—Pd1^ix	60.0
In5—Au2—Pd4^iv	60.0	In5^vi—In5—In5^x	120.0
Pd4ⁱⁱ—Au2—Pd4^iv	120.0	Pd1—In5—In5^x	60.0
In5ⁱⁱⁱ—Au2—Pd4^iv	120.0	Au2—In5—In5^x	60.0
In5^iv—Au2—Pd4^iv	0.0	In5^vii—In5—In5^x	60.0
Pd4^v—Au2—Pd4^iv	180.0	In5^viii—In5—In5^x	180.0
In5^v—Au2—Pd4^iv	180.0	Pd1^ix—In5—In5^x	120.0
In5ⁱⁱ—Au2—Pd4^iv	120.0	In5^vi—In5—Au3^vi	0.0
In5ⁱ—Au2—Pd4ⁱⁱⁱ	180.0	Pd1—In5—Au3^vi	120.0
Pd4—Au2—Pd4ⁱⁱⁱ	120.0	Au2—In5—Au3^vi	120.0
Au3—Au2—Pd4ⁱⁱⁱ	120.0	In5^vii—In5—Au3^vi	180.0
In5—Au2—Pd4ⁱⁱⁱ	120.0	In5^viii—In5—Au3^vi	60.0
Pd4ⁱⁱ—Au2—Pd4ⁱⁱⁱ	60.0	Pd1^ix—In5—Au3^vi	60.0
In5ⁱⁱⁱ—Au2—Pd4ⁱⁱⁱ	0.0	In5^x—In5—Au3^vi	120.0
In5^iv—Au2—Pd4ⁱⁱⁱ	120.0	In5^vi—In5—Au2^ix	60.0
Pd4^v—Au2—Pd4ⁱⁱⁱ	60.0	Pd1—In5—Au2^ix	180.0
In5^v—Au2—Pd4ⁱⁱⁱ	60.0	Au2—In5—Au2^ix	180.0
In5ⁱⁱ—Au2—Pd4ⁱⁱⁱ	60.0	In5^vii—In5—Au2^ix	120.0
Pd4^iv—Au2—Pd4ⁱⁱⁱ	120.0	In5^viii—In5—Au2^ix	60.0
In5^vi—Pd4—Pd1	120.0	Pd1^ix—In5—Au2^ix	0.0
In5^vi—Pd4—Au2	120.0	In5^x—In5—Au2^ix	120.0
Pd1—Pd4—Au2	0.0	Au3^vi—In5—Au2^ix	60.0
In5^vi—Pd4—In5^vii	180.0	In5^vi—In5—Pd4^x	120.0
Pd1—Pd4—In5^vii	60.0	Pd1—In5—Pd4^x	60.0
Au2—Pd4—In5^vii	60.0	Au2—In5—Pd4^x	60.0
In5^vi—Pd4—In5^viii	60.0	In5^vii—In5—Pd4^x	60.0
Pd1—Pd4—In5^viii	120.0	In5^viii—In5—Pd4^x	180.0
Au2—Pd4—In5^viii	120.0	Pd1^ix—In5—Pd4^x	120.0
In5^vii—Pd4—In5^viii	120.0	In5^x—In5—Pd4^x	0.0
In5^vi—Pd4—Pd1^ix	60.0	Au3^vi—In5—Pd4^x	120.0
Pd1—Pd4—Pd1^ix	180.0	Au2^ix—In5—Pd4^x	120.0
Au2—Pd4—Pd1^ix	180.0	In5^vi—In5—Au3^vii	180.0
In5^vii—Pd4—Pd1^ix	120.0	Pd1—In5—Au3^vii	60.0
In5^viii—Pd4—Pd1^ix	60.0	Au2—In5—Au3^vii	60.0
In5^vi—Pd4—In5^x	120.0	In5^vii—In5—Au3^vii	0.0
Pd1—Pd4—In5^x	60.0	In5^viii—In5—Au3^vii	120.0
Au2—Pd4—In5^x	60.0	Pd1^ix—In5—Au3^vii	120.0
In5^vii—Pd4—In5^x	60.0	In5^x—In5—Au3^vii	60.0
In5^viii—Pd4—In5^x	180.0	Au3^vi—In5—Au3^vii	180.0
Pd1^ix—Pd4—In5^x	120.0	Au2^ix—In5—Au3^vii	120.0
In5^vi—Pd4—Au3^vi	0.0	Pd4^x—In5—Au3^vii	60.0
Pd1—Pd4—Au3^vi	120.0	In5^vi—In5—Au3^viii	60.0
Au2—Pd4—Au3^vi	120.0	Pd1—In5—Au3^viii	120.0
In5^vii—Pd4—Au3^vi	180.0	Au2—In5—Au3^viii	120.0
In5^viii—Pd4—Au3^vi	60.0	In5^vii—In5—Au3^viii	120.0
Pd1^ix—Pd4—Au3^vi	60.0	In5^viii—In5—Au3^viii	0.0
In5^x—Pd4—Au3^vi	120.0	Pd1^ix—In5—Au3^viii	60.0
In5^vi—Pd4—Au2^ix	60.0	In5^x—In5—Au3^viii	180.0
Pd1—Pd4—Au2^ix	180.0	Au3^vi—In5—Au3^viii	60.0
Au2—Pd4—Au2^ix	180.0	Au2^ix—In5—Au3^viii	60.0
In5^vii—Pd4—Au2^ix	120.0	Pd4^x—In5—Au3^viii	180.0
In5^viii—Pd4—Au2^ix	60.0	Au3^vii—In5—Au3^viii	120.0

Refined atomic occupancies in samples 1–3 using models A and B top

Alloy No., composition	Occupancy on position	Model A	Model B
1, Au_30.8In_23.3Pd_45.9	1a	In: 0.12 (7)	Au: 0.005 (8)
		Pd: 0.88 (7)	Pd: 0.995 (8)
	3c	Au: 0.411	Au: 0.409 (3)
		In: 0.27 (2)	In: 0.311
		Pd: 0.32 (2)	Pd: 0.280 (3)
2, Au_37.3In_22.2Pd_40.5	1a	Au: 0.029 (4)	Au: 0.119 (4)
		In: 0.888	Pd: 0.881 (4)
		Pd: 0.083 (4)
	3c	Au: 0.4875 (19)	Au: 0.4576 (19)
		Pd: 0.5125 (19)	In: 0.296
			Pd: 0.2464 (19)
3, Au_44.2In_21.5Pd_34.3	1a	Au: 0.073 (7)	Au: 0.157 (7)
		In: 0.860	Pd: 0.843 (7)
		Pd: 0.067 (7)
	3c	Au: 0.565 (3)	Au: 0.537 (3)
		Pd: 0.435 (3)	In: 0.287
			Pd: 0.176 (3)

Results of structure refinement with the sigma's artificially increased by the factor of 10 for all `sublattice' reflections top

Alloy No., composition		Model A	Model B
1, Au_30.8In_23.3Pd_45.9	R	0.0244	0.0225
	wR(F²)	0.1095	0.1110
	GooF	0.932	0.926
	Occupancy on 1a	In: 0.20 (10)	Au: 0.0^a
		Pd: 0.80 (10)	Pd: 1.0^a
	Occupancy on 3c	Au: 0.411	Au: 0.410
		In: 0.24 (3)	In: 0.311
		Pd: 0.35 (3)	Pd: 0.279
2, Au_37.3In_22.2Pd_40.5	R	0.0285	0.0265
	wR(F²)	0.1212	0.1216
	GooF	0.745	0.748
	Occupancy on 1a	Au: 0.026 (10)	Au: 0.119 (10)
		In: 0.888	Pd: 0.881 (10)
		Pd: 0.086 (10)
	Occupancy on 3c	Au: 0.489 (4)	Au: 0.458 (4)
		Pd: 0.511 (4)	In: 0.296
			Pd: 0.246 (4)
3, Au_44.2In_21.5Pd_34.3	R	0.0230	0.0227
	wR(F²)	0.1573	0.1576
	GooF	0.795	0.797
	Occupancy on 1a	Au: 0.072 (12)	Au: 0.161 (12)
		In: 0.860	Pd: 0.839 (12)
		Pd: 0.068 (12)
	Occupancy on 3c	Au: 0.565 (4)	Au: 0.536 (4)
		Pd: 0.435 (4)	In: 0.287
			Pd: 0.177 (4)

Note: (a) manually fitted, refinement unstable.

Phase and chemical (EDX data) compositions of studied alloys in the Au–In–Pd ternary system top

Alloy No.	Average composition, at.%	Phase	Au, at.%	In, at.%	Pd, at.%
1	Au_30.8In_23.3Pd_45.9	τ	30.8	23.3	45.9
2	Au_37.3In_22.2Pd_40.5	τ	37.3	22.2	40.5
3	Au_47.1In_20.7Pd_32.2	τ	44.2	21.5	34.3
		fcc^a	51.2	20.4	28.4
4	Au_61.9In_13.9Pd_24.2	τ	49.8	17.5	32.7
		fcc	66.0	12.2	21.8
5	Au_11.5In_26.3Pd_62.2	τ	17.7	25.3	57.0
		InPd	8.0	33.1	58.9
		InPd₂	5.4	31.8	62.8
6	Au_20.9In_24.1Pd_55.0	τ	23.5	23.8	52.7
		InPd	12.8	35.1	52.1
7	Au_14.2In_29.1Pd_56.7	τ	18.9	25.3	55.8
		InPd	8.6	33.2	58.2
8	Au_22.5In_32.2Pd_45.3	τ	31.8	23.8	44.4
		InPd	21.7	33.0	45.3
9	Au_50.8In_16.2Pd_33.0	τ	50.8	16.2	33.0
10	Au_61.9In_15.7Pd_22.4	τ	48.4	19.5	32.1
		fcc	63.3	15.0	21.7

Note: (a) fcc is a phase based on (Au,Pd) solid solution.

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