metal-organic compounds\(\def\hfill{\hskip 5em}\def\hfil{\hskip 3em}\def\eqno#1{\hfil {#1}}\)

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ISSN: 2056-9890

μ2-Iodido-bis­­{dimeth­yl[methyl­bis­(quinolin-8-yl)silanyl-κ3N,Si,N′]platinum(IV)} tetra­kis(penta­fluoro­phen­yl)borate di­chloro­methane 0.66-solvate

aDepartment of Chemistry, University of California, Berkeley, Berkeley, CA 94720-1460, USA
*Correspondence e-mail: cgribble@berkeley.edu

(Received 14 November 2007; accepted 29 January 2008; online 13 February 2008)

The title complex, [Pt2(CH3)4(C19H15N2Si)2I][B(C6F5)4]·0.66CH2Cl2, resulted from an attempt to synthesize a stable five-coordinate platinum species via ligand abstraction of a six-coordinate platinum precursor. However, dimerization occurred after ligand abstraction, thereby yielding the compound described in this study. The cation is a dinuclear PtIV organometallic complex, in which the metal centers are bridged by an I anion. Both metal centers display a coordination geometry close to octa­hedral, including cis-arranged quinoline ligands connected by Si atoms, which form Pt—Si bonds, two cis-methyl groups, and the bridging I anion. In the crystal structure, voids between cations and anions are partially filled with an average of 0.66 mol­ecules of dichloro­methane solvent.

Related literature

Five-coordinate platinum compounds have been speculated to be inter­mediates in bond-activation processes (Brown et al., 1974[Brown, M. P., Puddephatt, R. J. & Upton, C. E. E. (1974). J. Chem. Soc. Dalton Trans. pp. 2457-2465.]). However, ligand abstraction of a six-coordinate platinum precursor carried out in the present study yielded a dinuclear six-coordinate complex.

[Scheme 1]

Experimental

Crystal data
  • [Pt2(CH3)4(C19H15N2Si)2I](C24F20B)·0.66CH2Cl2

  • Mr = 1911.14

  • Triclinic, [P \overline 1]

  • a = 13.9051 (10) Å

  • b = 15.3559 (11) Å

  • c = 17.1261 (12) Å

  • α = 71.930 (1)°

  • β = 72.045 (1)°

  • γ = 87.621 (1)°

  • V = 3301.3 (4) Å3

  • Z = 2

  • Mo Kα radiation

  • μ = 4.89 mm−1

  • T = 167 (2) K

  • 0.24 × 0.11 × 0.07 mm

Data collection
  • Bruker APEX CCD diffractometer

  • Absorption correction: multi-scan (SADABS; Bruker, 2002[Bruker (2002). SMART, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]) Tmin = 0.530, Tmax = 0.710

  • 30538 measured reflections

  • 13293 independent reflections

  • 11270 reflections with I > 2σ(I)

  • Rint = 0.020

Refinement
  • R[F2 > 2σ(F2)] = 0.025

  • wR(F2) = 0.065

  • S = 1.08

  • 13293 reflections

  • 898 parameters

  • H-atom parameters constrained

  • Δρmax = 0.94 e Å−3

  • Δρmin = −0.71 e Å−3

Table 1
Selected geometric parameters (Å, °)

I1—Pt2 2.9720 (3)
I1—Pt1 2.9770 (3)
Pt1—Si1 2.2591 (10)
Pt2—Si2 2.2556 (10)
Pt2—I1—Pt1 133.755 (10)

Data collection: SMART (Bruker, 2002[Bruker (2002). SMART, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]); cell refinement: SAINT (Bruker, 2002[Bruker (2002). SMART, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.]); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008[Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.]); molecular graphics: ORTEP-3 (Farrugia, 1997[Farrugia, L. J. (1997). J. Appl. Cryst. 30, 565.]) and POV-RAY (Cason, 2002[Cason, C. J. (2002). POV-RAY for Windows. Persistence of Vision Raytracer Pty. Ltd, Victoria, Australia.]); software used to prepare material for publication: SHELXL97.

Supporting information


Comment top

Five-coordinate platinum compounds have been speculated as intermediates in bond activation processes (Brown et al., 1974). During an attempt to synthesize such a stable five-coordinate platinum species via ligand abstraction of six-coordinate platinum precursor, we obtained the title complex (I). We assume that dimerization occurred after ligand abstraction, thereby yielding a dinuclear cationic complex. In the cation, both crystallographically independent PtIV ions display a coordination geometry close to octahedral, while Si atoms, as expected, are tetrahedrally bonded to two quinoline ligands, one methyl group, and one PtIV ion (Fig. 1). In the crystal, voids between cations and anions are partially filled with solvent molecules, giving a 0.66 dichloromethane solvate crystal (Fig. 2).

Related literature top

Five-coordinate platinum compounds have been speculated to be intermediates in bond-activation processes (Brown et al., 1974). However, ligand abstraction of a six-coordinate platinum precursor carried out in the present study yielded a dinuclear, six-coordinate complex.

Experimental top

Compound (I) was synthesized by addition of lithium tetrakis(perfluorophenyl)borate to a solution of the parent six-coordinate monomer in dichloromethane. X-ray quality single crystals were obtained by vapor diffusion of pentane into dichloromethane.

Refinement top

Structure refinement was conducted using least-squares analysis. Thermal parameters for all atoms except H were refined anisotropically. Solvent occupancy was allowed to refine with Uiso fixed and subsequently fixed at 0.66 during anisotropic refinement. H atoms were placed in calculated positions, and refined using a riding approximation, with C—H bond lengths constrained to 0.93 (aromatic CH), 0.97 (methylene CH2) or 0.96 Å (methyl CH3), and Uiso(H) = 1.2 Ueq(carrier C) for aromatic CH and methylene CH2 groups, and Uiso(H) = 1.5 Ueq(carrier C) for methyl groups. In order to get accurate torsion angles, methyl groups were allowed to rotate about their C—C bonds.

Computing details top

Data collection: SMART (Bruker, 2002); cell refinement: XPREP (Bruker, 2001); data reduction: SAINT (Bruker, 2002); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: ORTEP-3 (Farrugia, 1997) and POV-RAY (Cason, 2002); software used to prepare material for publication: SHELXL97 (Sheldrick, 2008).

Figures top
[Figure 1] Fig. 1. ORTEP-3 diagram of compound (I). H atoms are omitted for clarity.
[Figure 2] Fig. 2. Packing diagram with co-crystallized dichloromethane shown as the space-filling model.
µ2-Iodido-bis{dimethyl[methylbis(quinolin-8-yl)silanyl- κ3N,Si,N']platinum(IV)} tetrakis(pentafluorophenyl)borate dichloromethane 0.66-solvate top
Crystal data top
[Pt2(CH3)4(C19H15N2Si)2I](C24F20B)·0.66CH2Cl2Z = 2
Mr = 1911.14F(000) = 1831.4
Triclinic, P1Dx = 1.921 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 13.9051 (10) ÅCell parameters from 30538 reflections
b = 15.3559 (11) Åθ = 2.1–26.4°
c = 17.1261 (12) ŵ = 4.89 mm1
α = 71.930 (1)°T = 167 K
β = 72.045 (1)°Prism, colourless
γ = 87.621 (1)°0.24 × 0.11 × 0.07 mm
V = 3301.3 (4) Å3
Data collection top
Bruker APEX CCD
diffractometer
13293 independent reflections
Radiation source: fine-focus sealed tube, Bruker APEX11270 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.020
ω scansθmax = 26.4°, θmin = 2.1°
Absorption correction: multi-scan
(SADABS; Bruker, 2002)
h = 1117
Tmin = 0.530, Tmax = 0.710k = 1919
30538 measured reflectionsl = 2121
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.025Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.065H-atom parameters constrained
S = 1.08 w = 1/[σ2(Fo2) + (0.0365P)2]
where P = (Fo2 + 2Fc2)/3
13293 reflections(Δ/σ)max = 0.003
898 parametersΔρmax = 0.95 e Å3
0 restraintsΔρmin = 0.71 e Å3
Crystal data top
[Pt2(CH3)4(C19H15N2Si)2I](C24F20B)·0.66CH2Cl2γ = 87.621 (1)°
Mr = 1911.14V = 3301.3 (4) Å3
Triclinic, P1Z = 2
a = 13.9051 (10) ÅMo Kα radiation
b = 15.3559 (11) ŵ = 4.89 mm1
c = 17.1261 (12) ÅT = 167 K
α = 71.930 (1)°0.24 × 0.11 × 0.07 mm
β = 72.045 (1)°
Data collection top
Bruker APEX CCD
diffractometer
13293 independent reflections
Absorption correction: multi-scan
(SADABS; Bruker, 2002)
11270 reflections with I > 2σ(I)
Tmin = 0.530, Tmax = 0.710Rint = 0.020
30538 measured reflections
Refinement top
R[F2 > 2σ(F2)] = 0.0250 restraints
wR(F2) = 0.065H-atom parameters constrained
S = 1.08Δρmax = 0.95 e Å3
13293 reflectionsΔρmin = 0.71 e Å3
898 parameters
Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
C10.5927 (3)0.8330 (2)0.1569 (2)0.0282 (8)
H1A0.54900.86330.19160.034*
C20.6658 (3)0.8859 (2)0.0819 (3)0.0326 (9)
H2A0.66970.94950.06750.039*
C30.7308 (3)0.8432 (3)0.0304 (2)0.0304 (8)
H3A0.78040.87740.01920.036*
C40.7227 (3)0.7460 (2)0.0527 (2)0.0246 (8)
C50.7887 (3)0.6975 (3)0.0026 (3)0.0300 (8)
H5A0.83970.72910.04730.036*
C60.7776 (3)0.6041 (3)0.0275 (3)0.0316 (9)
H6A0.82190.57210.00500.038*
C70.7005 (3)0.5562 (3)0.1013 (2)0.0296 (8)
H7A0.69350.49260.11610.035*
C80.6344 (3)0.6000 (2)0.1528 (2)0.0250 (8)
C90.6462 (3)0.6969 (2)0.1286 (2)0.0222 (7)
C100.2819 (3)0.7299 (3)0.2598 (3)0.0356 (9)
H10A0.28870.77200.28710.043*
C110.1989 (3)0.7348 (3)0.2287 (3)0.0427 (11)
H11A0.15210.77900.23540.051*
C120.1883 (3)0.6733 (3)0.1885 (3)0.0419 (10)
H12A0.13420.67610.16680.050*
C130.2582 (3)0.6064 (3)0.1796 (3)0.0331 (9)
C140.2521 (4)0.5407 (3)0.1388 (3)0.0450 (11)
H14A0.19920.54100.11630.054*
C150.3226 (4)0.4770 (3)0.1321 (3)0.0472 (12)
H15A0.31810.43480.10430.057*
C160.4021 (3)0.4748 (3)0.1671 (3)0.0363 (9)
H16A0.44880.43000.16290.044*
C170.4129 (3)0.5371 (2)0.2074 (2)0.0293 (8)
C180.3408 (3)0.6045 (2)0.2129 (2)0.0281 (8)
C190.5971 (3)0.6374 (3)0.3545 (3)0.0363 (9)
H19A0.62750.58180.34800.054*
H19B0.57260.63250.41470.054*
H19C0.64650.68810.32410.054*
C200.3865 (3)0.5713 (3)0.4192 (3)0.0419 (10)
H20A0.33390.54270.40850.063*
H20B0.35690.60550.45820.063*
H20C0.42620.52490.44450.063*
C210.5518 (3)0.4274 (3)0.3099 (3)0.0398 (10)
H21A0.57440.39070.27220.060*
H21B0.49190.39810.35580.060*
H21C0.60400.43400.33390.060*
C220.3632 (3)0.9755 (3)0.4990 (2)0.0310 (8)
H22A0.37460.91490.50070.037*
C230.3762 (3)1.0041 (3)0.5660 (3)0.0357 (9)
H23A0.39410.96280.61120.043*
C240.3623 (3)1.0924 (3)0.5636 (3)0.0406 (10)
H24A0.37281.11270.60630.049*
C250.3319 (3)1.1539 (3)0.4965 (3)0.0340 (9)
C260.3132 (3)1.2469 (3)0.4902 (3)0.0479 (12)
H26A0.32211.27020.53180.057*
C270.2829 (4)1.3021 (3)0.4252 (3)0.0551 (13)
H27A0.27301.36340.42130.066*
C280.2659 (3)1.2677 (3)0.3629 (3)0.0419 (10)
H28A0.24391.30650.31880.050*
C290.2817 (3)1.1761 (3)0.3663 (3)0.0306 (9)
C300.3170 (3)1.1201 (3)0.4323 (2)0.0295 (8)
C310.1589 (3)0.8372 (2)0.4373 (2)0.0303 (8)
H31A0.21320.80160.44450.036*
C320.0610 (3)0.7944 (3)0.4749 (3)0.0364 (9)
H32A0.05140.73220.50600.044*
C330.0188 (3)0.8446 (3)0.4653 (3)0.0353 (9)
H33A0.08390.81700.48860.042*
C340.0029 (3)0.9392 (2)0.4198 (2)0.0271 (8)
C350.0832 (3)0.9962 (3)0.4075 (3)0.0328 (9)
H35A0.14950.97100.43040.039*
C360.0648 (3)1.0870 (3)0.3630 (3)0.0370 (10)
H36A0.11811.12380.35550.044*
C370.0360 (3)1.1255 (3)0.3280 (3)0.0341 (9)
H37A0.04761.18790.29790.041*
C380.1173 (3)1.0737 (2)0.3371 (2)0.0250 (8)
C390.0981 (3)0.9787 (2)0.3836 (2)0.0228 (7)
C400.4696 (3)1.0604 (3)0.2528 (3)0.0361 (9)
H40A0.47161.11660.26600.054*
H40B0.47911.07410.19220.054*
H40C0.52261.02330.26760.054*
C410.3279 (3)0.9685 (3)0.2114 (2)0.0318 (9)
H41A0.34171.02580.16540.048*
H41B0.26210.94300.22010.048*
H41C0.37820.92660.19650.048*
C420.2777 (4)1.2036 (3)0.1814 (3)0.0450 (11)
H42A0.23191.25200.18280.068*
H42B0.26831.17230.14350.068*
H42C0.34621.22910.16090.068*
C430.7438 (3)0.2082 (2)0.0728 (2)0.0231 (7)
C440.7338 (3)0.1558 (2)0.0219 (2)0.0270 (8)
C450.6554 (3)0.1602 (3)0.0123 (2)0.0312 (9)
C460.5817 (3)0.2207 (3)0.0014 (3)0.0339 (9)
C470.5896 (3)0.2774 (2)0.0480 (2)0.0299 (8)
C480.6680 (3)0.2697 (2)0.0821 (2)0.0246 (8)
C490.9330 (3)0.2601 (2)0.0168 (2)0.0221 (7)
C501.0032 (3)0.2259 (2)0.0421 (2)0.0256 (8)
C511.0698 (3)0.2809 (3)0.1188 (2)0.0266 (8)
C521.0678 (3)0.3745 (3)0.1411 (2)0.0292 (8)
C530.9984 (3)0.4116 (2)0.0859 (2)0.0273 (8)
C540.9335 (3)0.3553 (2)0.0105 (2)0.0245 (8)
C550.8299 (3)0.2420 (2)0.1879 (2)0.0223 (7)
C560.9035 (3)0.2909 (2)0.1992 (2)0.0245 (8)
C570.8893 (3)0.3211 (2)0.2696 (2)0.0284 (8)
C580.7979 (3)0.3032 (2)0.3339 (2)0.0313 (9)
C590.7230 (3)0.2533 (2)0.3277 (2)0.0292 (8)
C600.7413 (3)0.2234 (2)0.2565 (2)0.0254 (8)
C610.8718 (3)0.0923 (2)0.1483 (2)0.0231 (7)
C620.9665 (3)0.0714 (2)0.1555 (2)0.0249 (8)
C630.9933 (3)0.0154 (3)0.1944 (3)0.0298 (9)
C640.9221 (3)0.0866 (2)0.2319 (2)0.0305 (9)
C650.8251 (3)0.0704 (2)0.2285 (2)0.0281 (8)
C660.8022 (3)0.0170 (2)0.1872 (2)0.0248 (8)
C670.0752 (11)0.5150 (8)0.4112 (9)0.122 (4)0.66
H67A0.11260.49090.38230.147*0.66
H67B0.10820.48960.47300.147*0.66
N10.5823 (2)0.74187 (18)0.18139 (18)0.0220 (6)
N20.3514 (2)0.66832 (19)0.25244 (19)0.0261 (7)
N30.3360 (2)1.0299 (2)0.43409 (19)0.0253 (7)
N40.1783 (2)0.92465 (19)0.39265 (18)0.0232 (6)
B10.8452 (3)0.2007 (3)0.1062 (3)0.0231 (8)
Cl10.0568 (4)0.4763 (3)0.3846 (3)0.1616 (17)0.66
Cl20.0800 (3)0.6230 (2)0.3838 (2)0.1332 (14)0.66
F10.80500 (17)0.09582 (14)0.00363 (14)0.0345 (5)
F20.65082 (19)0.10489 (16)0.05899 (16)0.0464 (6)
F30.50501 (19)0.22623 (18)0.03129 (17)0.0510 (7)
F40.51852 (18)0.33806 (16)0.06101 (16)0.0429 (6)
F50.66725 (16)0.32833 (13)0.12742 (14)0.0308 (5)
F61.01229 (16)0.13451 (13)0.02676 (14)0.0329 (5)
F71.13855 (17)0.24295 (16)0.17102 (14)0.0390 (6)
F81.13372 (18)0.42857 (16)0.21388 (14)0.0423 (6)
F90.99416 (18)0.50378 (14)0.10509 (14)0.0404 (6)
F100.86536 (16)0.39738 (13)0.03881 (13)0.0302 (5)
F110.99707 (16)0.31049 (14)0.14062 (13)0.0294 (5)
F120.96573 (18)0.36638 (15)0.27686 (14)0.0392 (6)
F130.7830 (2)0.33331 (15)0.40263 (14)0.0443 (6)
F140.63277 (17)0.23398 (15)0.38999 (13)0.0387 (6)
F150.66365 (16)0.17265 (15)0.25679 (14)0.0328 (5)
F161.04155 (16)0.13871 (14)0.12469 (15)0.0335 (5)
F171.08923 (18)0.02941 (15)0.19654 (17)0.0445 (6)
F180.9457 (2)0.17045 (14)0.27213 (16)0.0462 (6)
F190.75214 (17)0.13898 (14)0.26455 (14)0.0376 (5)
F200.70486 (16)0.02546 (13)0.18756 (14)0.0331 (5)
I10.430471 (19)0.815649 (18)0.374301 (16)0.03229 (7)
Pt10.478070 (11)0.658600 (9)0.304310 (9)0.02414 (4)
Pt20.331383 (10)0.990179 (9)0.322963 (8)0.02269 (4)
Si10.52290 (8)0.54261 (7)0.24778 (7)0.0265 (2)
Si20.25226 (8)1.12171 (7)0.29133 (6)0.0266 (2)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
C10.030 (2)0.0266 (19)0.033 (2)0.0078 (16)0.0137 (17)0.0125 (16)
C20.038 (2)0.0187 (18)0.041 (2)0.0007 (16)0.0136 (19)0.0070 (16)
C30.025 (2)0.032 (2)0.031 (2)0.0043 (16)0.0069 (17)0.0069 (16)
C40.0215 (19)0.0306 (19)0.0257 (19)0.0018 (15)0.0117 (16)0.0103 (15)
C50.021 (2)0.039 (2)0.034 (2)0.0022 (16)0.0084 (17)0.0172 (17)
C60.025 (2)0.041 (2)0.038 (2)0.0112 (17)0.0107 (18)0.0243 (19)
C70.026 (2)0.0279 (19)0.037 (2)0.0045 (16)0.0079 (17)0.0150 (17)
C80.023 (2)0.0248 (18)0.030 (2)0.0029 (15)0.0096 (16)0.0106 (15)
C90.0219 (19)0.0233 (17)0.0265 (18)0.0042 (14)0.0135 (15)0.0091 (14)
C100.028 (2)0.038 (2)0.049 (3)0.0072 (18)0.0157 (19)0.0207 (19)
C110.029 (2)0.042 (2)0.062 (3)0.0119 (19)0.020 (2)0.017 (2)
C120.030 (2)0.046 (3)0.057 (3)0.0048 (19)0.024 (2)0.016 (2)
C130.027 (2)0.033 (2)0.041 (2)0.0037 (17)0.0148 (19)0.0089 (18)
C140.046 (3)0.044 (3)0.056 (3)0.006 (2)0.030 (2)0.017 (2)
C150.056 (3)0.039 (2)0.063 (3)0.000 (2)0.032 (3)0.025 (2)
C160.037 (2)0.028 (2)0.047 (3)0.0009 (18)0.015 (2)0.0143 (18)
C170.025 (2)0.0246 (18)0.035 (2)0.0016 (15)0.0071 (17)0.0070 (16)
C180.024 (2)0.0255 (18)0.032 (2)0.0060 (15)0.0071 (17)0.0061 (16)
C190.036 (2)0.039 (2)0.041 (2)0.0079 (19)0.023 (2)0.0129 (19)
C200.041 (3)0.045 (2)0.033 (2)0.001 (2)0.006 (2)0.0075 (19)
C210.043 (3)0.027 (2)0.044 (2)0.0059 (18)0.014 (2)0.0039 (18)
C220.025 (2)0.041 (2)0.028 (2)0.0012 (17)0.0071 (17)0.0132 (17)
C230.025 (2)0.057 (3)0.026 (2)0.0005 (19)0.0082 (17)0.0142 (19)
C240.023 (2)0.071 (3)0.037 (2)0.005 (2)0.0051 (18)0.032 (2)
C250.023 (2)0.046 (2)0.035 (2)0.0100 (18)0.0017 (17)0.0210 (19)
C260.045 (3)0.051 (3)0.055 (3)0.011 (2)0.009 (2)0.032 (2)
C270.061 (3)0.037 (2)0.070 (4)0.006 (2)0.012 (3)0.029 (2)
C280.044 (3)0.028 (2)0.047 (3)0.0074 (19)0.007 (2)0.0069 (19)
C290.019 (2)0.034 (2)0.035 (2)0.0111 (16)0.0020 (17)0.0158 (17)
C300.0191 (19)0.037 (2)0.030 (2)0.0086 (16)0.0017 (16)0.0160 (17)
C310.028 (2)0.0264 (19)0.034 (2)0.0035 (16)0.0057 (17)0.0099 (16)
C320.028 (2)0.027 (2)0.041 (2)0.0037 (17)0.0011 (19)0.0039 (17)
C330.024 (2)0.036 (2)0.037 (2)0.0094 (17)0.0018 (18)0.0098 (18)
C340.023 (2)0.033 (2)0.0257 (19)0.0006 (16)0.0065 (16)0.0115 (16)
C350.0159 (19)0.047 (2)0.036 (2)0.0026 (17)0.0062 (17)0.0152 (19)
C360.026 (2)0.042 (2)0.042 (2)0.0094 (18)0.0118 (19)0.0117 (19)
C370.035 (2)0.032 (2)0.035 (2)0.0048 (18)0.0134 (19)0.0078 (17)
C380.023 (2)0.0305 (19)0.0222 (18)0.0027 (15)0.0082 (15)0.0082 (15)
C390.0232 (19)0.0260 (18)0.0190 (17)0.0010 (15)0.0055 (15)0.0076 (14)
C400.023 (2)0.050 (2)0.033 (2)0.0066 (18)0.0069 (18)0.0100 (19)
C410.033 (2)0.040 (2)0.030 (2)0.0048 (18)0.0141 (18)0.0167 (17)
C420.051 (3)0.041 (2)0.034 (2)0.003 (2)0.011 (2)0.0003 (19)
C430.0203 (19)0.0215 (17)0.0249 (18)0.0007 (14)0.0063 (15)0.0041 (14)
C440.028 (2)0.0244 (18)0.029 (2)0.0018 (15)0.0063 (17)0.0106 (15)
C450.039 (2)0.031 (2)0.029 (2)0.0019 (17)0.0135 (18)0.0128 (16)
C460.032 (2)0.041 (2)0.032 (2)0.0040 (18)0.0189 (18)0.0066 (17)
C470.027 (2)0.031 (2)0.031 (2)0.0049 (16)0.0101 (17)0.0070 (16)
C480.027 (2)0.0216 (17)0.0259 (19)0.0005 (15)0.0079 (16)0.0087 (14)
C490.0234 (19)0.0218 (17)0.0244 (18)0.0006 (14)0.0113 (15)0.0079 (14)
C500.027 (2)0.0264 (18)0.030 (2)0.0014 (15)0.0126 (17)0.0142 (15)
C510.023 (2)0.036 (2)0.0249 (19)0.0027 (16)0.0082 (16)0.0150 (16)
C520.027 (2)0.038 (2)0.0196 (18)0.0052 (17)0.0067 (16)0.0050 (16)
C530.030 (2)0.0235 (18)0.030 (2)0.0014 (16)0.0147 (17)0.0064 (15)
C540.024 (2)0.0263 (18)0.0263 (19)0.0054 (15)0.0099 (16)0.0111 (15)
C550.0236 (19)0.0178 (16)0.0267 (19)0.0062 (14)0.0102 (16)0.0069 (14)
C560.026 (2)0.0209 (17)0.0268 (19)0.0061 (15)0.0090 (16)0.0068 (14)
C570.034 (2)0.0236 (18)0.035 (2)0.0036 (16)0.0185 (18)0.0124 (16)
C580.050 (3)0.0279 (19)0.0225 (19)0.0107 (18)0.0155 (19)0.0140 (16)
C590.037 (2)0.0258 (18)0.0197 (18)0.0090 (17)0.0048 (17)0.0047 (15)
C600.026 (2)0.0230 (18)0.0276 (19)0.0065 (15)0.0106 (16)0.0066 (15)
C610.027 (2)0.0216 (17)0.0232 (18)0.0035 (15)0.0068 (15)0.0109 (14)
C620.024 (2)0.0241 (18)0.0297 (19)0.0009 (15)0.0084 (16)0.0131 (15)
C630.029 (2)0.033 (2)0.040 (2)0.0115 (17)0.0191 (18)0.0206 (17)
C640.041 (2)0.0207 (18)0.033 (2)0.0080 (17)0.0154 (19)0.0089 (15)
C650.031 (2)0.0205 (18)0.029 (2)0.0015 (15)0.0021 (17)0.0092 (15)
C660.022 (2)0.0254 (18)0.0288 (19)0.0053 (15)0.0064 (16)0.0134 (15)
C670.143 (13)0.089 (8)0.153 (12)0.002 (8)0.070 (10)0.036 (8)
N10.0207 (16)0.0228 (15)0.0270 (16)0.0059 (12)0.0123 (13)0.0095 (12)
N20.0222 (17)0.0270 (16)0.0294 (17)0.0026 (13)0.0087 (14)0.0089 (13)
N30.0203 (16)0.0320 (16)0.0239 (16)0.0031 (13)0.0038 (13)0.0114 (13)
N40.0196 (16)0.0273 (15)0.0239 (15)0.0021 (12)0.0068 (13)0.0098 (12)
B10.022 (2)0.0231 (19)0.026 (2)0.0051 (16)0.0076 (18)0.0109 (16)
Cl10.230 (5)0.125 (3)0.132 (3)0.012 (3)0.052 (3)0.046 (3)
Cl20.227 (4)0.0683 (17)0.109 (2)0.004 (2)0.059 (3)0.0270 (17)
F10.0365 (13)0.0351 (12)0.0415 (13)0.0090 (10)0.0138 (11)0.0243 (10)
F20.0575 (17)0.0516 (15)0.0496 (15)0.0035 (13)0.0287 (13)0.0308 (12)
F30.0483 (16)0.0623 (17)0.0609 (17)0.0088 (13)0.0394 (14)0.0230 (14)
F40.0345 (14)0.0459 (14)0.0552 (15)0.0181 (11)0.0223 (12)0.0193 (12)
F50.0315 (12)0.0289 (11)0.0412 (13)0.0090 (9)0.0164 (10)0.0197 (10)
F60.0344 (13)0.0274 (11)0.0356 (12)0.0053 (10)0.0037 (10)0.0156 (9)
F70.0351 (14)0.0508 (14)0.0324 (12)0.0082 (11)0.0041 (10)0.0218 (11)
F80.0413 (15)0.0462 (14)0.0259 (12)0.0078 (11)0.0004 (11)0.0015 (10)
F90.0503 (16)0.0245 (11)0.0375 (13)0.0016 (10)0.0089 (11)0.0014 (10)
F100.0314 (12)0.0259 (11)0.0321 (12)0.0082 (9)0.0054 (10)0.0125 (9)
F110.0254 (12)0.0312 (11)0.0338 (12)0.0026 (9)0.0078 (10)0.0141 (9)
F120.0512 (16)0.0380 (13)0.0384 (13)0.0025 (11)0.0218 (12)0.0174 (11)
F130.0676 (18)0.0432 (14)0.0308 (13)0.0115 (12)0.0183 (12)0.0215 (11)
F140.0389 (14)0.0422 (13)0.0259 (12)0.0090 (11)0.0002 (10)0.0092 (10)
F150.0253 (12)0.0407 (13)0.0308 (12)0.0036 (10)0.0047 (10)0.0122 (10)
F160.0258 (12)0.0298 (11)0.0483 (14)0.0018 (9)0.0151 (11)0.0133 (10)
F170.0377 (14)0.0392 (13)0.0698 (17)0.0144 (11)0.0332 (13)0.0204 (12)
F180.0625 (17)0.0247 (12)0.0569 (16)0.0114 (11)0.0330 (14)0.0071 (11)
F190.0394 (14)0.0227 (11)0.0410 (13)0.0037 (10)0.0002 (11)0.0082 (10)
F200.0224 (12)0.0244 (11)0.0470 (14)0.0016 (9)0.0054 (10)0.0091 (10)
I10.02772 (14)0.04357 (15)0.03540 (14)0.01162 (11)0.01362 (11)0.02336 (12)
Pt10.02348 (8)0.02635 (8)0.02421 (8)0.00427 (6)0.00920 (6)0.00873 (6)
Pt20.01752 (8)0.03071 (8)0.02077 (7)0.00020 (6)0.00455 (6)0.01054 (6)
Si10.0257 (6)0.0216 (5)0.0317 (6)0.0034 (4)0.0097 (5)0.0072 (4)
Si20.0246 (6)0.0280 (5)0.0243 (5)0.0037 (4)0.0058 (4)0.0054 (4)
Geometric parameters (Å, º) top
C1—N11.331 (4)C36—H36A0.9300
C1—C21.399 (5)C37—C381.375 (5)
C1—H1A0.9300C37—H37A0.9300
C2—C31.357 (5)C38—C391.419 (5)
C2—H2A0.9300C38—Si21.879 (4)
C3—C41.421 (5)C39—N41.380 (4)
C3—H3A0.9300C40—Pt22.060 (4)
C4—C51.409 (5)C40—H40A0.9600
C4—C91.413 (5)C40—H40B0.9600
C5—C61.364 (5)C40—H40C0.9600
C5—H5A0.9300C41—Pt22.054 (3)
C6—C71.393 (5)C41—H41A0.9600
C6—H6A0.9300C41—H41B0.9600
C7—C81.376 (5)C41—H41C0.9600
C7—H7A0.9300C42—Si21.846 (4)
C8—C91.418 (5)C42—H42A0.9600
C8—Si11.870 (4)C42—H42B0.9600
C9—N11.387 (4)C42—H42C0.9600
C10—N21.328 (5)C43—C481.391 (5)
C10—C111.403 (6)C43—C441.395 (5)
C10—H10A0.9300C43—B11.664 (5)
C11—C121.366 (6)C44—F11.355 (4)
C11—H11A0.9300C44—C451.379 (5)
C12—C131.395 (6)C45—F21.349 (4)
C12—H12A0.9300C45—C461.371 (5)
C13—C141.412 (6)C46—F31.337 (4)
C13—C181.427 (5)C46—C471.378 (5)
C14—C151.360 (6)C47—F41.346 (4)
C14—H14A0.9300C47—C481.373 (5)
C15—C161.406 (6)C48—F51.357 (4)
C15—H15A0.9300C49—C501.387 (5)
C16—C171.380 (5)C49—C541.388 (5)
C16—H16A0.9300C49—B11.656 (5)
C17—C181.414 (5)C50—F61.354 (4)
C17—Si11.877 (4)C50—C511.387 (5)
C18—N21.387 (4)C51—F71.342 (4)
C19—Pt12.059 (4)C51—C521.370 (5)
C19—H19A0.9600C52—F81.342 (4)
C19—H19B0.9600C52—C531.369 (5)
C19—H19C0.9600C53—F91.354 (4)
C20—Pt12.062 (4)C53—C541.372 (5)
C20—H20A0.9600C54—F101.351 (4)
C20—H20B0.9600C55—C601.381 (5)
C20—H20C0.9600C55—C561.387 (5)
C21—Si11.860 (4)C55—B11.663 (5)
C21—H21A0.9600C56—F111.353 (4)
C21—H21B0.9600C56—C571.378 (5)
C21—H21C0.9600C57—F121.350 (4)
C22—N31.316 (5)C57—C581.372 (5)
C22—C231.411 (5)C58—F131.350 (4)
C22—H22A0.9300C58—C591.367 (6)
C23—C241.352 (6)C59—F141.345 (4)
C23—H23A0.9300C59—C601.381 (5)
C24—C251.408 (6)C60—F151.355 (4)
C24—H24A0.9300C61—C621.376 (5)
C25—C261.418 (6)C61—C661.391 (5)
C25—C301.422 (5)C61—B11.673 (5)
C26—C271.346 (7)C62—F161.359 (4)
C26—H26A0.9300C62—C631.385 (5)
C27—C281.410 (6)C63—F171.353 (4)
C27—H27A0.9300C63—C641.361 (5)
C28—C291.400 (5)C64—F181.339 (4)
C28—H28A0.9300C64—C651.376 (5)
C29—C301.402 (6)C65—F191.349 (4)
C29—Si21.879 (4)C65—C661.385 (5)
C30—N31.393 (5)C66—F201.352 (4)
C31—N41.314 (4)C67—Cl21.582 (11)
C31—C321.404 (5)C67—Cl11.869 (14)
C31—H31A0.9300C67—H67A0.9700
C32—C331.347 (5)C67—H67B0.9700
C32—H32A0.9300N1—Pt12.184 (3)
C33—C341.409 (5)N2—Pt12.186 (3)
C33—H33A0.9300N3—Pt22.190 (3)
C34—C351.416 (5)N4—Pt22.199 (3)
C34—C391.424 (5)I1—Pt22.9720 (3)
C35—C361.357 (6)I1—Pt12.9770 (3)
C35—H35A0.9300Pt1—Si12.2591 (10)
C36—C371.415 (6)Pt2—Si22.2556 (10)
N1—C1—C2123.7 (3)H42A—C42—H42C109.5
N1—C1—H1A118.1H42B—C42—H42C109.5
C2—C1—H1A118.1C48—C43—C44112.5 (3)
C3—C2—C1119.2 (3)C48—C43—B1127.1 (3)
C3—C2—H2A120.4C44—C43—B1120.1 (3)
C1—C2—H2A120.4F1—C44—C45116.2 (3)
C2—C3—C4119.6 (4)F1—C44—C43119.2 (3)
C2—C3—H3A120.2C45—C44—C43124.6 (3)
C4—C3—H3A120.2F2—C45—C46119.9 (3)
C5—C4—C9119.4 (3)F2—C45—C44120.3 (3)
C5—C4—C3122.4 (3)C46—C45—C44119.8 (3)
C9—C4—C3118.2 (3)F3—C46—C45120.9 (3)
C6—C5—C4119.7 (4)F3—C46—C47120.6 (4)
C6—C5—H5A120.1C45—C46—C47118.5 (3)
C4—C5—H5A120.1F4—C47—C48121.0 (3)
C5—C6—C7120.7 (3)F4—C47—C46119.2 (3)
C5—C6—H6A119.7C48—C47—C46119.7 (3)
C7—C6—H6A119.7F5—C48—C47114.4 (3)
C8—C7—C6122.0 (3)F5—C48—C43120.7 (3)
C8—C7—H7A119.0C47—C48—C43124.9 (3)
C6—C7—H7A119.0C50—C49—C54113.0 (3)
C7—C8—C9118.0 (3)C50—C49—B1127.2 (3)
C7—C8—Si1125.0 (3)C54—C49—B1119.4 (3)
C9—C8—Si1116.8 (3)F6—C50—C49121.2 (3)
N1—C9—C4121.1 (3)F6—C50—C51115.1 (3)
N1—C9—C8118.7 (3)C49—C50—C51123.7 (3)
C4—C9—C8120.2 (3)F7—C51—C52119.3 (3)
N2—C10—C11123.6 (4)F7—C51—C50120.4 (3)
N2—C10—H10A118.2C52—C51—C50120.3 (3)
C11—C10—H10A118.2F8—C52—C53120.8 (3)
C12—C11—C10118.7 (4)F8—C52—C51121.0 (3)
C12—C11—H11A120.7C53—C52—C51118.2 (3)
C10—C11—H11A120.7F9—C53—C52120.2 (3)
C11—C12—C13120.4 (4)F9—C53—C54119.8 (3)
C11—C12—H12A119.8C52—C53—C54120.0 (3)
C13—C12—H12A119.8F10—C54—C53116.1 (3)
C12—C13—C14123.5 (4)F10—C54—C49119.1 (3)
C12—C13—C18118.4 (4)C53—C54—C49124.7 (3)
C14—C13—C18118.1 (4)C60—C55—C56112.9 (3)
C15—C14—C13120.9 (4)C60—C55—B1121.3 (3)
C15—C14—H14A119.5C56—C55—B1125.6 (3)
C13—C14—H14A119.5F11—C56—C57115.1 (3)
C14—C15—C16120.2 (4)F11—C56—C55120.8 (3)
C14—C15—H15A119.9C57—C56—C55124.0 (3)
C16—C15—H15A119.9F12—C57—C58119.6 (3)
C17—C16—C15121.9 (4)F12—C57—C56120.5 (3)
C17—C16—H16A119.1C58—C57—C56119.9 (3)
C15—C16—H16A119.1F13—C58—C59120.7 (4)
C16—C17—C18117.9 (4)F13—C58—C57120.3 (4)
C16—C17—Si1123.5 (3)C59—C58—C57118.9 (3)
C18—C17—Si1118.4 (3)F14—C59—C58120.3 (3)
N2—C18—C17118.5 (3)F14—C59—C60120.7 (4)
N2—C18—C13120.5 (3)C58—C59—C60119.0 (4)
C17—C18—C13120.9 (3)F15—C60—C59115.0 (3)
Pt1—C19—H19A109.5F15—C60—C55119.9 (3)
Pt1—C19—H19B109.5C59—C60—C55125.1 (4)
H19A—C19—H19B109.5C62—C61—C66113.1 (3)
Pt1—C19—H19C109.5C62—C61—B1121.0 (3)
H19A—C19—H19C109.5C66—C61—B1125.6 (3)
H19B—C19—H19C109.5F16—C62—C61120.1 (3)
Pt1—C20—H20A109.5F16—C62—C63115.1 (3)
Pt1—C20—H20B109.5C61—C62—C63124.8 (3)
H20A—C20—H20B109.5F17—C63—C64119.8 (3)
Pt1—C20—H20C109.5F17—C63—C62120.4 (3)
H20A—C20—H20C109.5C64—C63—C62119.7 (3)
H20B—C20—H20C109.5F18—C64—C63120.6 (4)
Si1—C21—H21A109.5F18—C64—C65120.8 (4)
Si1—C21—H21B109.5C63—C64—C65118.5 (3)
H21A—C21—H21B109.5F19—C65—C64120.6 (3)
Si1—C21—H21C109.5F19—C65—C66119.5 (3)
H21A—C21—H21C109.5C64—C65—C66119.9 (3)
H21B—C21—H21C109.5F20—C66—C65115.1 (3)
N3—C22—C23123.6 (4)F20—C66—C61121.0 (3)
N3—C22—H22A118.2C65—C66—C61123.9 (3)
C23—C22—H22A118.2Cl2—C67—Cl1113.3 (8)
C24—C23—C22119.1 (4)Cl2—C67—H67A108.9
C24—C23—H23A120.5Cl1—C67—H67A108.9
C22—C23—H23A120.5Cl2—C67—H67B108.9
C23—C24—C25120.2 (4)Cl1—C67—H67B108.9
C23—C24—H24A119.9H67A—C67—H67B107.7
C25—C24—H24A119.9C1—N1—C9118.1 (3)
C24—C25—C26123.8 (4)C1—N1—Pt1123.7 (2)
C24—C25—C30118.0 (4)C9—N1—Pt1118.1 (2)
C26—C25—C30118.1 (4)C10—N2—C18118.4 (3)
C27—C26—C25121.2 (4)C10—N2—Pt1123.4 (3)
C27—C26—H26A119.4C18—N2—Pt1118.2 (2)
C25—C26—H26A119.4C22—N3—C30118.3 (3)
C26—C27—C28120.5 (4)C22—N3—Pt2123.7 (2)
C26—C27—H27A119.8C30—N3—Pt2117.8 (2)
C28—C27—H27A119.8C31—N4—C39118.7 (3)
C29—C28—C27121.0 (4)C31—N4—Pt2124.3 (2)
C29—C28—H28A119.5C39—N4—Pt2116.9 (2)
C27—C28—H28A119.5C49—B1—C55113.0 (3)
C28—C29—C30118.1 (4)C49—B1—C43101.6 (3)
C28—C29—Si2124.2 (3)C55—B1—C43113.4 (3)
C30—C29—Si2117.7 (3)C49—B1—C61114.6 (3)
N3—C30—C29118.1 (3)C55—B1—C61101.8 (3)
N3—C30—C25120.8 (4)C43—B1—C61113.0 (3)
C29—C30—C25121.1 (4)Pt2—I1—Pt1133.755 (10)
N4—C31—C32123.8 (4)C19—Pt1—C2089.23 (18)
N4—C31—H31A118.1C19—Pt1—N188.67 (14)
C32—C31—H31A118.1C20—Pt1—N1175.45 (14)
C33—C32—C31119.2 (4)C19—Pt1—N2175.02 (13)
C33—C32—H32A120.4C20—Pt1—N288.42 (15)
C31—C32—H32A120.4N1—Pt1—N293.36 (11)
C32—C33—C34119.6 (4)C19—Pt1—Si190.71 (11)
C32—C33—H33A120.2C20—Pt1—Si192.18 (12)
C34—C33—H33A120.2N1—Pt1—Si183.81 (7)
C33—C34—C35122.7 (4)N2—Pt1—Si184.99 (8)
C33—C34—C39118.6 (3)C19—Pt1—I187.36 (11)
C35—C34—C39118.7 (3)C20—Pt1—I190.20 (12)
C36—C35—C34120.9 (4)N1—Pt1—I193.73 (7)
C36—C35—H35A119.5N2—Pt1—I197.04 (7)
C34—C35—H35A119.5Si1—Pt1—I1176.91 (3)
C35—C36—C37119.7 (4)C41—Pt2—C4087.51 (16)
C35—C36—H36A120.1C41—Pt2—N3173.53 (13)
C37—C36—H36A120.1C40—Pt2—N389.24 (14)
C38—C37—C36122.2 (4)C41—Pt2—N491.29 (14)
C38—C37—H37A118.9C40—Pt2—N4175.47 (14)
C36—C37—H37A118.9N3—Pt2—N491.53 (10)
C37—C38—C39118.2 (3)C41—Pt2—Si290.71 (11)
C37—C38—Si2123.6 (3)C40—Pt2—Si290.25 (12)
C39—C38—Si2118.2 (3)N3—Pt2—Si283.72 (8)
N4—C39—C38119.5 (3)N4—Pt2—Si285.39 (8)
N4—C39—C34120.2 (3)C41—Pt2—I191.84 (11)
C38—C39—C34120.3 (3)C40—Pt2—I191.38 (12)
Pt2—C40—H40A109.5N3—Pt2—I193.82 (8)
Pt2—C40—H40B109.5N4—Pt2—I193.03 (7)
H40A—C40—H40B109.5Si2—Pt2—I1177.03 (3)
Pt2—C40—H40C109.5C21—Si1—C8111.53 (18)
H40A—C40—H40C109.5C21—Si1—C17112.32 (18)
H40B—C40—H40C109.5C8—Si1—C17108.13 (16)
Pt2—C41—H41A109.5C21—Si1—Pt1123.55 (14)
Pt2—C41—H41B109.5C8—Si1—Pt1100.08 (11)
H41A—C41—H41B109.5C17—Si1—Pt199.61 (12)
Pt2—C41—H41C109.5C42—Si2—C38111.40 (19)
H41A—C41—H41C109.5C42—Si2—C29111.50 (19)
H41B—C41—H41C109.5C38—Si2—C29109.66 (16)
Si2—C42—H42A109.5C42—Si2—Pt2124.05 (15)
Si2—C42—H42B109.5C38—Si2—Pt299.38 (11)
H42A—C42—H42B109.5C29—Si2—Pt299.48 (13)
Si2—C42—H42C109.5
N1—C1—C2—C30.3 (6)F17—C63—C64—F181.0 (5)
C1—C2—C3—C41.0 (6)C62—C63—C64—F18178.0 (3)
C2—C3—C4—C5179.1 (4)F17—C63—C64—C65179.8 (3)
C2—C3—C4—C90.0 (5)C62—C63—C64—C651.2 (5)
C9—C4—C5—C60.5 (5)F18—C64—C65—F191.1 (5)
C3—C4—C5—C6179.6 (3)C63—C64—C65—F19179.8 (3)
C4—C5—C6—C71.1 (6)F18—C64—C65—C66179.5 (3)
C5—C6—C7—C81.5 (6)C63—C64—C65—C660.4 (5)
C6—C7—C8—C90.3 (6)F19—C65—C66—F200.6 (5)
C6—C7—C8—Si1175.0 (3)C64—C65—C66—F20180.0 (3)
C5—C4—C9—N1177.5 (3)F19—C65—C66—C61179.8 (3)
C3—C4—C9—N11.6 (5)C64—C65—C66—C610.8 (5)
C5—C4—C9—C81.8 (5)C62—C61—C66—F20178.8 (3)
C3—C4—C9—C8179.1 (3)B1—C61—C66—F205.5 (5)
C7—C8—C9—N1177.9 (3)C62—C61—C66—C650.3 (5)
Si1—C8—C9—N16.9 (4)B1—C61—C66—C65173.7 (3)
C7—C8—C9—C41.3 (5)C2—C1—N1—C91.3 (5)
Si1—C8—C9—C4173.8 (3)C2—C1—N1—Pt1174.0 (3)
N2—C10—C11—C120.1 (7)C4—C9—N1—C12.3 (5)
C10—C11—C12—C130.8 (7)C8—C9—N1—C1178.5 (3)
C11—C12—C13—C14180.0 (4)C4—C9—N1—Pt1173.3 (2)
C11—C12—C13—C180.5 (7)C8—C9—N1—Pt16.0 (4)
C12—C13—C14—C15180.0 (4)C11—C10—N2—C180.9 (6)
C18—C13—C14—C150.5 (7)C11—C10—N2—Pt1178.2 (3)
C13—C14—C15—C161.0 (7)C17—C18—N2—C10178.0 (3)
C14—C15—C16—C171.3 (7)C13—C18—N2—C101.2 (5)
C15—C16—C17—C180.0 (6)C17—C18—N2—Pt10.6 (4)
C15—C16—C17—Si1175.3 (3)C13—C18—N2—Pt1178.6 (3)
C16—C17—C18—N2179.3 (3)C23—C22—N3—C301.3 (5)
Si1—C17—C18—N23.8 (5)C23—C22—N3—Pt2173.2 (3)
C16—C17—C18—C131.5 (6)C29—C30—N3—C22175.9 (3)
Si1—C17—C18—C13177.1 (3)C25—C30—N3—C223.2 (5)
C12—C13—C18—N20.5 (6)C29—C30—N3—Pt29.2 (4)
C14—C13—C18—N2179.0 (4)C25—C30—N3—Pt2171.6 (3)
C12—C13—C18—C17178.7 (4)C32—C31—N4—C391.8 (5)
C14—C13—C18—C171.8 (6)C32—C31—N4—Pt2173.9 (3)
N3—C22—C23—C241.5 (6)C38—C39—N4—C31178.7 (3)
C22—C23—C24—C252.1 (6)C34—C39—N4—C312.1 (5)
C23—C24—C25—C26178.4 (4)C38—C39—N4—Pt25.3 (4)
C23—C24—C25—C300.2 (6)C34—C39—N4—Pt2173.9 (2)
C24—C25—C26—C27179.0 (4)C50—C49—B1—C55141.1 (3)
C30—C25—C26—C270.4 (7)C54—C49—B1—C5546.3 (4)
C25—C26—C27—C281.9 (7)C50—C49—B1—C4397.1 (4)
C26—C27—C28—C291.0 (7)C54—C49—B1—C4375.6 (4)
C27—C28—C29—C301.4 (6)C50—C49—B1—C6125.0 (5)
C27—C28—C29—Si2175.3 (3)C54—C49—B1—C61162.4 (3)
C28—C29—C30—N3177.9 (3)C60—C55—B1—C49158.0 (3)
Si2—C29—C30—N35.1 (5)C56—C55—B1—C4927.3 (5)
C28—C29—C30—C253.0 (6)C60—C55—B1—C4343.1 (4)
Si2—C29—C30—C25174.0 (3)C56—C55—B1—C43142.3 (3)
C24—C25—C30—N32.5 (6)C60—C55—B1—C6178.6 (4)
C26—C25—C30—N3178.8 (4)C56—C55—B1—C6196.1 (4)
C24—C25—C30—C29176.6 (4)C48—C43—B1—C4997.3 (4)
C26—C25—C30—C292.1 (6)C44—C43—B1—C4975.6 (4)
N4—C31—C32—C330.0 (6)C48—C43—B1—C5524.3 (5)
C31—C32—C33—C341.5 (6)C44—C43—B1—C55162.8 (3)
C32—C33—C34—C35179.7 (4)C48—C43—B1—C61139.5 (3)
C32—C33—C34—C391.1 (6)C44—C43—B1—C6147.6 (4)
C33—C34—C35—C36179.8 (4)C62—C61—B1—C4944.8 (4)
C39—C34—C35—C360.6 (6)C66—C61—B1—C49142.4 (3)
C34—C35—C36—C370.1 (6)C62—C61—B1—C5577.6 (4)
C35—C36—C37—C380.3 (6)C66—C61—B1—C5595.3 (4)
C36—C37—C38—C390.3 (6)C62—C61—B1—C43160.4 (3)
C36—C37—C38—Si2179.6 (3)C66—C61—B1—C4326.7 (5)
C37—C38—C39—N4178.9 (3)C1—N1—Pt1—C1997.0 (3)
Si2—C38—C39—N41.0 (4)C9—N1—Pt1—C1978.3 (3)
C37—C38—C39—C340.2 (5)C1—N1—Pt1—N287.6 (3)
Si2—C38—C39—C34179.9 (3)C9—N1—Pt1—N297.1 (2)
C33—C34—C39—N40.7 (5)C1—N1—Pt1—Si1172.2 (3)
C35—C34—C39—N4178.5 (3)C9—N1—Pt1—Si112.5 (2)
C33—C34—C39—C38179.9 (3)C1—N1—Pt1—I19.7 (3)
C35—C34—C39—C380.7 (5)C9—N1—Pt1—I1165.6 (2)
C48—C43—C44—F1176.9 (3)C10—N2—Pt1—C2088.5 (3)
B1—C43—C44—F13.1 (5)C18—N2—Pt1—C2088.9 (3)
C48—C43—C44—C453.0 (5)C10—N2—Pt1—N195.7 (3)
B1—C43—C44—C45176.8 (3)C18—N2—Pt1—N187.0 (3)
F1—C44—C45—F21.9 (5)C10—N2—Pt1—Si1179.2 (3)
C43—C44—C45—F2178.3 (3)C18—N2—Pt1—Si13.5 (3)
F1—C44—C45—C46178.4 (3)C10—N2—Pt1—I11.5 (3)
C43—C44—C45—C461.5 (6)C18—N2—Pt1—I1178.9 (2)
F2—C45—C46—F30.3 (6)Pt2—I1—Pt1—C19152.31 (12)
C44—C45—C46—F3179.9 (4)Pt2—I1—Pt1—C20118.47 (13)
F2—C45—C46—C47178.8 (3)Pt2—I1—Pt1—N163.82 (7)
C44—C45—C46—C471.4 (6)Pt2—I1—Pt1—N230.04 (8)
F3—C46—C47—F40.6 (6)C22—N3—Pt2—C4099.6 (3)
C45—C46—C47—F4179.1 (3)C30—N3—Pt2—C4075.0 (3)
F3—C46—C47—C48179.0 (3)C22—N3—Pt2—N484.9 (3)
C45—C46—C47—C482.5 (6)C30—N3—Pt2—N4100.6 (3)
F4—C47—C48—F51.0 (5)C22—N3—Pt2—Si2170.1 (3)
C46—C47—C48—F5179.3 (3)C30—N3—Pt2—Si215.4 (2)
F4—C47—C48—C43179.1 (3)C22—N3—Pt2—I18.2 (3)
C46—C47—C48—C430.8 (6)C30—N3—Pt2—I1166.3 (2)
C44—C43—C48—F5178.0 (3)C31—N4—Pt2—C4192.5 (3)
B1—C43—C48—F54.7 (6)C39—N4—Pt2—C4183.2 (2)
C44—C43—C48—C471.8 (5)C39—N4—Pt2—N391.0 (2)
B1—C43—C48—C47175.1 (3)C31—N4—Pt2—Si2176.9 (3)
C54—C49—C50—F6179.1 (3)C39—N4—Pt2—Si27.4 (2)
B1—C49—C50—F66.0 (5)C31—N4—Pt2—I10.6 (3)
C54—C49—C50—C512.2 (5)C39—N4—Pt2—I1175.1 (2)
B1—C49—C50—C51175.2 (3)Pt1—I1—Pt2—C417.74 (12)
F6—C50—C51—F71.5 (5)Pt1—I1—Pt2—C4095.29 (11)
C49—C50—C51—F7177.3 (3)Pt1—I1—Pt2—N3175.38 (8)
F6—C50—C51—C52179.9 (3)Pt1—I1—Pt2—N483.64 (7)
C49—C50—C51—C521.0 (6)C7—C8—Si1—C2138.2 (4)
F7—C51—C52—F80.4 (5)C9—C8—Si1—C21147.0 (3)
C50—C51—C52—F8178.0 (3)C7—C8—Si1—C1785.8 (3)
F7—C51—C52—C53178.6 (3)C9—C8—Si1—C1789.0 (3)
C50—C51—C52—C530.3 (6)C7—C8—Si1—Pt1170.5 (3)
F8—C52—C53—F91.3 (5)C9—C8—Si1—Pt114.7 (3)
C51—C52—C53—F9179.6 (3)C16—C17—Si1—C2146.6 (4)
F8—C52—C53—C54178.0 (3)C18—C17—Si1—C21138.1 (3)
C51—C52—C53—C540.3 (6)C16—C17—Si1—C876.9 (4)
F9—C53—C54—F102.8 (5)C18—C17—Si1—C898.4 (3)
C52—C53—C54—F10177.9 (3)C16—C17—Si1—Pt1179.1 (3)
F9—C53—C54—C49178.2 (3)C18—C17—Si1—Pt15.6 (3)
C52—C53—C54—C491.1 (6)C19—Pt1—Si1—C2148.3 (2)
C50—C49—C54—F10176.8 (3)C20—Pt1—Si1—C2141.0 (2)
B1—C49—C54—F103.2 (5)N1—Pt1—Si1—C21136.86 (19)
C50—C49—C54—C532.3 (5)N2—Pt1—Si1—C21129.2 (2)
B1—C49—C54—C53175.9 (3)C19—Pt1—Si1—C876.13 (17)
C60—C55—C56—F11176.2 (3)C20—Pt1—Si1—C8165.39 (17)
B1—C55—C56—F111.2 (5)N1—Pt1—Si1—C812.45 (14)
C60—C55—C56—C572.3 (5)N2—Pt1—Si1—C8106.39 (14)
B1—C55—C56—C57177.4 (3)C19—Pt1—Si1—C17173.35 (17)
F11—C56—C57—F120.3 (5)C20—Pt1—Si1—C1784.08 (17)
C55—C56—C57—F12178.3 (3)N1—Pt1—Si1—C1798.07 (14)
F11—C56—C57—C58178.6 (3)N2—Pt1—Si1—C174.13 (14)
C55—C56—C57—C580.0 (5)C37—C38—Si2—C4241.5 (4)
F12—C57—C58—F132.3 (5)C39—C38—Si2—C42138.4 (3)
C56—C57—C58—F13179.3 (3)C37—C38—Si2—C2982.4 (3)
F12—C57—C58—C59176.7 (3)C39—C38—Si2—C2997.7 (3)
C56—C57—C58—C591.6 (5)C37—C38—Si2—Pt2173.9 (3)
F13—C58—C59—F140.5 (5)C39—C38—Si2—Pt26.0 (3)
C57—C58—C59—F14179.5 (3)C28—C29—Si2—C4235.5 (4)
F13—C58—C59—C60179.8 (3)C30—C29—Si2—C42147.7 (3)
C57—C58—C59—C600.7 (5)C28—C29—Si2—C3888.3 (4)
F14—C59—C60—F151.8 (5)C30—C29—Si2—C3888.5 (3)
C58—C59—C60—F15178.5 (3)C28—C29—Si2—Pt2168.1 (3)
F14—C59—C60—C55177.8 (3)C30—C29—Si2—Pt215.2 (3)
C58—C59—C60—C551.9 (5)C41—Pt2—Si2—C4238.8 (2)
C56—C55—C60—F15177.1 (3)C40—Pt2—Si2—C4248.7 (2)
B1—C55—C60—F151.9 (5)N3—Pt2—Si2—C42137.9 (2)
C56—C55—C60—C593.3 (5)N4—Pt2—Si2—C42130.0 (2)
B1—C55—C60—C59178.6 (3)C41—Pt2—Si2—C3885.15 (16)
C66—C61—C62—F16176.6 (3)C40—Pt2—Si2—C38172.66 (16)
B1—C61—C62—F162.9 (5)N3—Pt2—Si2—C3898.14 (13)
C66—C61—C62—C632.0 (5)N4—Pt2—Si2—C386.08 (13)
B1—C61—C62—C63175.7 (3)C41—Pt2—Si2—C29162.93 (16)
F16—C62—C63—F172.9 (5)C40—Pt2—Si2—C2975.42 (16)
C61—C62—C63—F17178.5 (3)N3—Pt2—Si2—C2913.79 (14)
F16—C62—C63—C64176.1 (3)N4—Pt2—Si2—C29105.84 (14)
C61—C62—C63—C642.5 (6)

Experimental details

Crystal data
Chemical formula[Pt2(CH3)4(C19H15N2Si)2I](C24F20B)·0.66CH2Cl2
Mr1911.14
Crystal system, space groupTriclinic, P1
Temperature (K)167
a, b, c (Å)13.9051 (10), 15.3559 (11), 17.1261 (12)
α, β, γ (°)71.930 (1), 72.045 (1), 87.621 (1)
V3)3301.3 (4)
Z2
Radiation typeMo Kα
µ (mm1)4.89
Crystal size (mm)0.24 × 0.11 × 0.07
Data collection
DiffractometerBruker APEX CCD
diffractometer
Absorption correctionMulti-scan
(SADABS; Bruker, 2002)
Tmin, Tmax0.530, 0.710
No. of measured, independent and
observed [I > 2σ(I)] reflections
30538, 13293, 11270
Rint0.020
(sin θ/λ)max1)0.625
Refinement
R[F2 > 2σ(F2)], wR(F2), S 0.025, 0.065, 1.08
No. of reflections13293
No. of parameters898
H-atom treatmentH-atom parameters constrained
Δρmax, Δρmin (e Å3)0.95, 0.71

Computer programs: SMART (Bruker, 2002), XPREP (Bruker, 2001), SAINT (Bruker, 2002), SHELXS97 (Sheldrick, 2008), SHELXL97 (Sheldrick, 2008), ORTEP-3 (Farrugia, 1997) and POV-RAY (Cason, 2002).

Selected geometric parameters (Å, º) top
I1—Pt22.9720 (3)Pt1—Si12.2591 (10)
I1—Pt12.9770 (3)Pt2—Si22.2556 (10)
Pt2—I1—Pt1133.755 (10)
 

Acknowledgements

We thank Dr Fred Hollander and Michael Pluth for assistance throughout the CHEM 208 course, as well as Professor Kenneth Raymond for teaching the course. We thank Preeyanuch Sangtrirutnugul for providing us with a sample.

References

First citationBrown, M. P., Puddephatt, R. J. & Upton, C. E. E. (1974). J. Chem. Soc. Dalton Trans. pp. 2457–2465.  CrossRef Web of Science Google Scholar
First citationBruker (2002). SMART, SAINT and SADABS. Bruker AXS Inc., Madison, Wisconsin, USA.  Google Scholar
First citationCason, C. J. (2002). POV-RAY for Windows. Persistence of Vision Raytracer Pty. Ltd, Victoria, Australia.  Google Scholar
First citationFarrugia, L. J. (1997). J. Appl. Cryst. 30, 565.  CrossRef IUCr Journals Google Scholar
First citationSheldrick, G. M. (2008). Acta Cryst. A64, 112–122.  Web of Science CrossRef CAS IUCr Journals Google Scholar

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