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The title compound, [Cu2(C2H3O2)2(C26H24P2)3]·2C4H10O, crystallizes with one dicopper(I) unit located on a centre of inversion and two diethyl ether mol­ecules in general positions. The Cu atoms exhibit slightly distorted tetra­hedral coordination.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805031089/nc6048sup1.cif
Contains datablocks 3, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805031089/nc60483sup2.hkl
Contains datablock 3

CCDC reference: 289818

Key indicators

  • Single-crystal X-ray study
  • T = 173 K
  • Mean [sigma](C-C) = 0.017 Å
  • R factor = 0.119
  • wR factor = 0.291
  • Data-to-parameter ratio = 15.7

checkCIF/PLATON results

No syntax errors found



Alert level B DIFMX01_ALERT_2_B The maximum difference density is > 0.1*ZMAX*1.00 _refine_diff_density_max given = 3.039 Test value = 2.900 PLAT097_ALERT_2_B Maximum (Positive) Residual Density ............ 3.04 e/A   3 PLAT341_ALERT_3_B Low Bond Precision on C-C bonds (x 1000) Ang ... 17
Alert level C DIFMX02_ALERT_1_C The maximum difference density is > 0.1*ZMAX*0.75 The relevant atom site should be identified. RFACG01_ALERT_3_C The value of the R factor is > 0.10 R factor given 0.119 RFACR01_ALERT_3_C The value of the weighted R factor is > 0.25 Weighted R factor given 0.291 PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT062_ALERT_4_C Rescale T(min) & T(max) by ..................... 0.98 PLAT082_ALERT_2_C High R1 Value .................................. 0.12 PLAT084_ALERT_2_C High R2 Value .................................. 0.29 PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.06 PLAT125_ALERT_4_C No _symmetry_space_group_name_Hall Given ....... ? PLAT213_ALERT_2_C Atom C43 has ADP max/min Ratio ............. 3.10 prolat PLAT213_ALERT_2_C Atom C71 has ADP max/min Ratio ............. 3.20 prolat PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.30 Ratio PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 3.03 Ratio PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C71 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C82 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C84 PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.14
0 ALERT level A = In general: serious problem 3 ALERT level B = Potentially serious problem 17 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 10 ALERT type 2 Indicator that the structure model may be wrong or deficient 4 ALERT type 3 Indicator that the structure quality may be low 4 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: X-AREA (Stoe & Cie, 2001); cell refinement: X-AREA; data reduction: X-AREA; program(s) used to solve structure: SHELXS97 (Sheldrick, 1990); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: XP in SHELXTL-Plus (Sheldrick, 1991); software used to prepare material for publication: SHELXL97 and PLATON (Spek, 2003).

µ-1,2-Ethanediylbis(diphenylphosphine)-κ2P:P'-bis{acetato[1,2- ethanediylbis(diphenylphosphine)-κ2P,P']copper(I)} diethyl ether disolvate top
Crystal data top
[Cu2(C2H3O2)2(C26H24P2)3]·2C4H10OZ = 1
Mr = 1588.58F(000) = 834
Triclinic, P1Dx = 1.297 Mg m3
a = 12.6520 (9) ÅMo Kα radiation, λ = 0.71073 Å
b = 12.8760 (9) ÅCell parameters from 42635 reflections
c = 14.2907 (11) Åθ = 3.6–25.6°
α = 85.069 (6)°µ = 0.69 mm1
β = 83.287 (6)°T = 173 K
γ = 61.629 (5)°Block, colourless
V = 2033.2 (3) Å30.52 × 0.48 × 0.44 mm
Data collection top
Stoe IPDS-II two-circle
diffractometer
7379 independent reflections
Radiation source: fine-focus sealed tube6686 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.091
ω scansθmax = 25.4°, θmin = 3.6°
Absorption correction: multi-scan
(MULABS; Spek, 2003; Blessing, 1995)
h = 1515
Tmin = 0.714, Tmax = 0.750k = 1515
42630 measured reflectionsl = 1717
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)] = 0.119Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.291H-atom parameters constrained
S = 1.13 w = 1/[σ2(Fo2) + (0.067P)2 + 33.8808P]
where P = (Fo2 + 2Fc2)/3
7379 reflections(Δ/σ)max < 0.001
469 parametersΔρmax = 3.04 e Å3
0 restraintsΔρmin = 1.48 e Å3
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.

Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Cu10.42001 (9)0.33781 (8)0.37325 (7)0.0229 (3)
P10.5964 (2)0.24905 (18)0.27189 (16)0.0269 (5)
P20.3144 (2)0.31020 (18)0.26825 (16)0.0260 (5)
P30.37349 (18)0.52948 (16)0.39475 (15)0.0206 (4)
C10.5447 (8)0.2007 (8)0.1762 (7)0.0330 (19)
H1A0.59810.19280.11790.040*
H1B0.55050.12220.19380.040*
C20.4138 (9)0.2887 (8)0.1571 (6)0.036 (2)
H2A0.38710.25790.10870.043*
H2B0.40880.36520.13320.043*
C30.4953 (7)0.5307 (7)0.4508 (6)0.0263 (17)
H3A0.57240.48890.41160.032*
H3B0.47900.61320.45680.032*
C110.7298 (8)0.1079 (7)0.3006 (6)0.0277 (18)
C120.8434 (9)0.0714 (8)0.2531 (7)0.038 (2)
H120.85580.12130.20510.046*
C130.9400 (9)0.0388 (9)0.2756 (8)0.044 (2)
H131.01770.06320.24340.053*
C140.9212 (9)0.1110 (7)0.3443 (7)0.039 (2)
H140.98600.18590.35940.047*
C150.8074 (9)0.0751 (8)0.3922 (8)0.042 (2)
H150.79490.12600.43910.050*
C160.7111 (8)0.0362 (7)0.3713 (7)0.034 (2)
H160.63420.06190.40520.041*
C210.6664 (9)0.3361 (8)0.2100 (7)0.035 (2)
C220.6445 (10)0.3817 (9)0.1175 (7)0.041 (2)
H220.59480.36490.08320.049*
C230.6950 (11)0.4512 (10)0.0757 (8)0.050 (3)
H230.67630.48540.01430.060*
C240.7747 (12)0.4711 (11)0.1249 (8)0.055 (3)
H240.81410.51360.09480.066*
C250.7945 (10)0.4283 (9)0.2167 (8)0.045 (2)
H250.84550.44390.25050.054*
C260.7396 (9)0.3620 (8)0.2600 (7)0.034 (2)
H260.75200.33450.32360.041*
C310.1673 (8)0.4290 (7)0.2387 (6)0.0291 (19)
C320.0871 (8)0.4873 (7)0.3143 (7)0.0313 (19)
H320.10820.46220.37700.038*
C330.0278 (8)0.5857 (8)0.2975 (8)0.039 (2)
H330.08490.62450.34880.047*
C340.0538 (9)0.6227 (9)0.2070 (8)0.045 (2)
H340.12770.69100.19570.054*
C350.0246 (10)0.5633 (10)0.1311 (8)0.050 (3)
H350.00280.58850.06860.060*
C360.1365 (9)0.4656 (8)0.1468 (7)0.040 (2)
H360.19090.42480.09500.047*
C410.2961 (7)0.1762 (7)0.2761 (6)0.0271 (18)
C420.2423 (10)0.1514 (8)0.2074 (8)0.044 (3)
H420.21220.20520.15540.053*
C430.2327 (11)0.0458 (9)0.2152 (8)0.050 (3)
H430.19930.02700.16720.060*
C440.2717 (10)0.0295 (8)0.2924 (7)0.043 (2)
H440.26110.09810.29920.051*
C450.3264 (9)0.0063 (8)0.3603 (7)0.040 (2)
H450.35680.06090.41170.048*
C460.3374 (9)0.0983 (8)0.3534 (7)0.036 (2)
H460.37260.11550.40110.043*
C510.3646 (8)0.6156 (7)0.2844 (6)0.0284 (18)
C520.2614 (11)0.6557 (9)0.2373 (7)0.044 (2)
H520.19850.63900.26400.053*
C530.2478 (13)0.7200 (10)0.1518 (8)0.056 (3)
H530.17620.74650.12120.067*
C540.3369 (16)0.7450 (10)0.1120 (8)0.075 (5)
H540.32800.78810.05350.091*
C550.4421 (15)0.7064 (11)0.1584 (9)0.069 (4)
H550.50350.72490.13110.083*
C560.4583 (10)0.6409 (9)0.2442 (8)0.046 (2)
H560.53010.61420.27450.055*
C610.2401 (7)0.6367 (6)0.4653 (6)0.0230 (16)
C620.1522 (7)0.6074 (7)0.5098 (6)0.0266 (17)
H620.16190.53020.50460.032*
C630.0507 (8)0.6910 (8)0.5615 (7)0.038 (2)
H630.00790.67020.59170.045*
C640.0351 (8)0.8049 (8)0.5689 (7)0.037 (2)
H640.03470.86180.60320.045*
C650.1225 (7)0.8351 (7)0.5258 (7)0.0306 (19)
H650.11300.91200.53180.037*
C660.2232 (7)0.7523 (6)0.4742 (6)0.0248 (17)
H660.28160.77360.44450.030*
C710.3501 (7)0.2663 (6)0.5492 (6)0.0241 (17)
C720.3601 (11)0.2284 (11)0.6539 (8)0.052 (3)
H72A0.27940.25100.68520.078*
H72B0.39730.26750.68340.078*
H72C0.40990.14260.65990.078*
O710.4425 (5)0.2507 (5)0.4995 (4)0.0321 (14)
O720.2433 (6)0.3139 (5)0.5225 (5)0.0379 (15)
C810.381 (3)0.124 (3)0.9233 (16)0.183 (15)
H81A0.45410.07060.88570.274*
H81B0.39950.12280.98810.274*
H81C0.34940.20400.89580.274*
C820.2887 (15)0.0830 (16)0.9238 (13)0.097 (6)
H82A0.27120.08290.85810.117*
H82B0.32200.00080.94980.117*
O830.1805 (10)0.1540 (10)0.9772 (7)0.086 (3)
C840.0948 (19)0.1106 (16)0.9743 (12)0.093 (5)
H84A0.13130.02570.99340.112*
H84B0.06990.12020.90970.112*
C850.0103 (19)0.180 (2)1.0402 (13)0.131 (9)
H85A0.06980.15141.04080.196*
H85B0.04660.26341.01990.196*
H85C0.01570.17071.10370.196*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Cu10.0236 (5)0.0131 (5)0.0353 (6)0.0105 (4)0.0074 (4)0.0007 (4)
P10.0324 (12)0.0211 (10)0.0334 (12)0.0170 (9)0.0052 (9)0.0002 (8)
P20.0310 (11)0.0199 (10)0.0346 (12)0.0169 (9)0.0084 (9)0.0002 (8)
P30.0193 (10)0.0104 (9)0.0337 (11)0.0070 (7)0.0087 (8)0.0010 (7)
C10.035 (5)0.029 (4)0.041 (5)0.020 (4)0.001 (4)0.005 (4)
C20.049 (6)0.037 (5)0.031 (5)0.030 (5)0.002 (4)0.004 (4)
C30.024 (4)0.021 (4)0.037 (5)0.012 (3)0.011 (3)0.002 (3)
C110.029 (4)0.020 (4)0.038 (5)0.014 (3)0.005 (4)0.000 (3)
C120.044 (6)0.033 (5)0.038 (5)0.018 (4)0.004 (4)0.000 (4)
C130.035 (5)0.045 (6)0.054 (6)0.019 (5)0.000 (5)0.007 (5)
C140.041 (5)0.014 (4)0.057 (6)0.008 (4)0.010 (5)0.004 (4)
C150.044 (6)0.021 (4)0.066 (7)0.019 (4)0.019 (5)0.013 (4)
C160.031 (5)0.021 (4)0.051 (6)0.013 (4)0.008 (4)0.002 (4)
C210.049 (6)0.026 (4)0.038 (5)0.025 (4)0.002 (4)0.004 (4)
C220.064 (7)0.045 (6)0.032 (5)0.042 (5)0.004 (4)0.003 (4)
C230.069 (8)0.056 (7)0.042 (6)0.045 (6)0.011 (5)0.011 (5)
C240.082 (9)0.062 (7)0.050 (6)0.061 (7)0.002 (6)0.006 (5)
C250.056 (7)0.040 (6)0.056 (6)0.037 (5)0.005 (5)0.001 (5)
C260.041 (5)0.030 (5)0.039 (5)0.023 (4)0.000 (4)0.001 (4)
C310.030 (4)0.021 (4)0.048 (5)0.020 (4)0.010 (4)0.002 (4)
C320.032 (5)0.021 (4)0.049 (5)0.018 (4)0.012 (4)0.002 (4)
C330.025 (5)0.027 (5)0.069 (7)0.015 (4)0.003 (4)0.005 (4)
C340.037 (5)0.033 (5)0.062 (7)0.014 (4)0.008 (5)0.009 (5)
C350.054 (7)0.043 (6)0.055 (7)0.025 (5)0.017 (5)0.020 (5)
C360.050 (6)0.024 (4)0.040 (5)0.015 (4)0.004 (4)0.004 (4)
C410.028 (4)0.015 (4)0.041 (5)0.011 (3)0.010 (4)0.002 (3)
C420.056 (6)0.023 (5)0.067 (7)0.026 (5)0.030 (5)0.012 (4)
C430.071 (8)0.030 (5)0.071 (7)0.037 (5)0.038 (6)0.010 (5)
C440.060 (7)0.018 (4)0.056 (6)0.023 (4)0.010 (5)0.003 (4)
C450.052 (6)0.022 (4)0.052 (6)0.021 (4)0.018 (5)0.011 (4)
C460.040 (5)0.028 (5)0.045 (5)0.019 (4)0.017 (4)0.006 (4)
C510.040 (5)0.018 (4)0.032 (4)0.017 (4)0.004 (4)0.000 (3)
C520.066 (7)0.033 (5)0.045 (6)0.031 (5)0.022 (5)0.007 (4)
C530.094 (10)0.043 (6)0.040 (6)0.038 (7)0.021 (6)0.010 (5)
C540.135 (14)0.035 (6)0.028 (6)0.020 (8)0.002 (7)0.009 (5)
C550.103 (11)0.041 (6)0.062 (8)0.040 (7)0.031 (8)0.002 (6)
C560.051 (6)0.030 (5)0.054 (6)0.019 (5)0.001 (5)0.005 (4)
C610.022 (4)0.013 (3)0.038 (5)0.010 (3)0.011 (3)0.001 (3)
C620.023 (4)0.018 (4)0.044 (5)0.012 (3)0.009 (3)0.001 (3)
C630.030 (5)0.036 (5)0.053 (6)0.020 (4)0.005 (4)0.001 (4)
C640.027 (5)0.025 (4)0.050 (6)0.004 (4)0.007 (4)0.006 (4)
C650.023 (4)0.016 (4)0.051 (5)0.006 (3)0.010 (4)0.001 (4)
C660.021 (4)0.011 (3)0.045 (5)0.008 (3)0.010 (3)0.000 (3)
C710.029 (4)0.007 (3)0.041 (5)0.010 (3)0.013 (4)0.004 (3)
C720.054 (7)0.053 (7)0.047 (6)0.025 (6)0.005 (5)0.010 (5)
O710.031 (3)0.020 (3)0.044 (4)0.010 (3)0.008 (3)0.003 (3)
O720.032 (3)0.026 (3)0.054 (4)0.013 (3)0.008 (3)0.004 (3)
C810.25 (3)0.30 (4)0.125 (19)0.23 (3)0.08 (2)0.11 (2)
C820.075 (11)0.083 (11)0.110 (14)0.015 (9)0.010 (10)0.048 (10)
O830.078 (7)0.097 (8)0.070 (6)0.028 (6)0.009 (5)0.009 (6)
C840.136 (17)0.086 (12)0.067 (10)0.057 (12)0.025 (10)0.003 (8)
C850.108 (16)0.22 (3)0.070 (12)0.085 (18)0.004 (11)0.027 (14)
Geometric parameters (Å, º) top
Cu1—O712.015 (6)C41—C461.395 (12)
Cu1—P22.275 (2)C41—C421.396 (13)
Cu1—P32.289 (2)C42—C431.414 (12)
Cu1—P12.343 (2)C42—H420.9500
P1—C211.847 (9)C43—C441.376 (14)
P1—C11.851 (9)C43—H430.9500
P1—C111.855 (9)C44—C451.383 (14)
P2—C311.830 (9)C44—H440.9500
P2—C411.839 (8)C45—C461.413 (12)
P2—C21.859 (9)C45—H450.9500
P3—C31.825 (8)C46—H460.9500
P3—C511.831 (9)C51—C521.388 (13)
P3—C611.844 (8)C51—C561.420 (13)
C1—C21.539 (13)C52—C531.395 (14)
C1—H1A0.9900C52—H520.9500
C1—H1B0.9900C53—C541.36 (2)
C2—H2A0.9900C53—H530.9500
C2—H2B0.9900C54—C551.41 (2)
C3—C3i1.541 (16)C54—H540.9500
C3—H3A0.9900C55—C561.404 (16)
C3—H3B0.9900C55—H550.9500
C11—C161.385 (12)C56—H560.9500
C11—C121.390 (13)C61—C621.405 (11)
C12—C131.406 (14)C61—C661.414 (10)
C12—H120.9500C62—C631.399 (13)
C13—C141.373 (14)C62—H620.9500
C13—H130.9500C63—C641.395 (13)
C14—C151.395 (14)C63—H630.9500
C14—H140.9500C64—C651.402 (13)
C15—C161.407 (12)C64—H640.9500
C15—H150.9500C65—C661.388 (12)
C16—H160.9500C65—H650.9500
C21—C221.402 (13)C66—H660.9500
C21—C261.403 (13)C71—O711.233 (10)
C22—C231.388 (13)C71—O721.281 (10)
C22—H220.9500C71—C721.533 (13)
C23—C241.421 (15)C72—H72A0.9800
C23—H230.9500C72—H72B0.9800
C24—C251.381 (15)C72—H72C0.9800
C24—H240.9500C81—C821.48 (3)
C25—C261.403 (12)C81—H81A0.9800
C25—H250.9500C81—H81B0.9800
C26—H260.9500C81—H81C0.9800
C31—C321.386 (13)C82—O831.407 (17)
C31—C361.392 (13)C82—H82A0.9900
C32—C331.433 (12)C82—H82B0.9900
C32—H320.9500O83—C841.44 (2)
C33—C341.361 (15)C84—C851.47 (3)
C33—H330.9500C84—H84A0.9900
C34—C351.384 (16)C84—H84B0.9900
C34—H340.9500C85—H85A0.9800
C35—C361.403 (15)C85—H85B0.9800
C35—H350.9500C85—H85C0.9800
C36—H360.9500
O71—Cu1—P2119.63 (18)C31—C36—C35119.6 (10)
O71—Cu1—P3108.90 (18)C31—C36—H36120.2
P2—Cu1—P3116.12 (8)C35—C36—H36120.2
O71—Cu1—P1110.51 (18)C46—C41—C42119.8 (8)
P2—Cu1—P190.30 (9)C46—C41—P2118.4 (6)
P3—Cu1—P1109.61 (8)C42—C41—P2121.8 (6)
C21—P1—C1104.1 (4)C41—C42—C43119.8 (9)
C21—P1—C11102.2 (4)C41—C42—H42120.1
C1—P1—C1199.7 (4)C43—C42—H42120.1
C21—P1—Cu1121.3 (3)C44—C43—C42120.0 (9)
C1—P1—Cu1101.9 (3)C44—C43—H43120.0
C11—P1—Cu1123.7 (3)C42—C43—H43120.0
C31—P2—C41104.4 (4)C43—C44—C45120.5 (8)
C31—P2—C2104.4 (4)C43—C44—H44119.7
C41—P2—C2101.8 (4)C45—C44—H44119.7
C31—P2—Cu1120.7 (3)C44—C45—C46120.2 (9)
C41—P2—Cu1120.6 (3)C44—C45—H45119.9
C2—P2—Cu1102.0 (3)C46—C45—H45119.9
C3—P3—C51104.4 (4)C41—C46—C45119.5 (8)
C3—P3—C61101.2 (4)C41—C46—H46120.2
C51—P3—C61100.7 (4)C45—C46—H46120.2
C3—P3—Cu1108.9 (3)C52—C51—C56118.9 (9)
C51—P3—Cu1113.6 (3)C52—C51—P3117.7 (7)
C61—P3—Cu1125.8 (2)C56—C51—P3123.4 (7)
C2—C1—P1111.8 (6)C51—C52—C53121.7 (11)
C2—C1—H1A109.3C51—C52—H52119.2
P1—C1—H1A109.3C53—C52—H52119.2
C2—C1—H1B109.3C54—C53—C52120.3 (12)
P1—C1—H1B109.3C54—C53—H53119.9
H1A—C1—H1B107.9C52—C53—H53119.9
C1—C2—P2109.4 (6)C53—C54—C55119.4 (10)
C1—C2—H2A109.8C53—C54—H54120.3
P2—C2—H2A109.8C55—C54—H54120.3
C1—C2—H2B109.8C56—C55—C54121.4 (12)
P2—C2—H2B109.8C56—C55—H55119.3
H2A—C2—H2B108.2C54—C55—H55119.3
C3i—C3—P3109.4 (7)C55—C56—C51118.4 (11)
C3i—C3—H3A109.8C55—C56—H56120.8
P3—C3—H3A109.8C51—C56—H56120.8
C3i—C3—H3B109.8C62—C61—C66118.5 (7)
P3—C3—H3B109.8C62—C61—P3121.5 (6)
H3A—C3—H3B108.2C66—C61—P3120.0 (6)
C16—C11—C12120.2 (8)C63—C62—C61120.4 (7)
C16—C11—P1116.7 (7)C63—C62—H62119.8
C12—C11—P1123.1 (7)C61—C62—H62119.8
C11—C12—C13120.4 (9)C64—C63—C62120.3 (8)
C11—C12—H12119.8C64—C63—H63119.8
C13—C12—H12119.8C62—C63—H63119.8
C14—C13—C12119.5 (9)C63—C64—C65119.9 (8)
C14—C13—H13120.2C63—C64—H64120.1
C12—C13—H13120.2C65—C64—H64120.1
C13—C14—C15120.4 (9)C66—C65—C64119.9 (8)
C13—C14—H14119.8C66—C65—H65120.1
C15—C14—H14119.8C64—C65—H65120.1
C14—C15—C16120.3 (9)C65—C66—C61121.1 (8)
C14—C15—H15119.9C65—C66—H66119.5
C16—C15—H15119.9C61—C66—H66119.5
C11—C16—C15119.2 (9)O71—C71—O72126.2 (8)
C11—C16—H16120.4O71—C71—C72118.5 (8)
C15—C16—H16120.4O72—C71—C72115.2 (8)
C22—C21—C26119.1 (8)C71—C72—H72A109.5
C22—C21—P1122.8 (7)C71—C72—H72B109.5
C26—C21—P1118.0 (7)H72A—C72—H72B109.5
C23—C22—C21120.5 (9)C71—C72—H72C109.5
C23—C22—H22119.7H72A—C72—H72C109.5
C21—C22—H22119.7H72B—C72—H72C109.5
C22—C23—C24119.9 (10)C71—O71—Cu1116.6 (5)
C22—C23—H23120.1C82—C81—H81A109.5
C24—C23—H23120.1C82—C81—H81B109.5
C25—C24—C23119.7 (9)H81A—C81—H81B109.5
C25—C24—H24120.2C82—C81—H81C109.5
C23—C24—H24120.2H81A—C81—H81C109.5
C24—C25—C26120.2 (9)H81B—C81—H81C109.5
C24—C25—H25119.9O83—C82—C81113.1 (16)
C26—C25—H25119.9O83—C82—H82A109.0
C25—C26—C21120.5 (9)C81—C82—H82A109.0
C25—C26—H26119.8O83—C82—H82B109.0
C21—C26—H26119.8C81—C82—H82B109.0
C32—C31—C36120.2 (8)H82A—C82—H82B107.8
C32—C31—P2115.9 (7)C82—O83—C84110.3 (14)
C36—C31—P2123.8 (7)O83—C84—C85107.4 (15)
C31—C32—C33119.8 (9)O83—C84—H84A110.2
C31—C32—H32120.1C85—C84—H84A110.2
C33—C32—H32120.1O83—C84—H84B110.2
C34—C33—C32118.9 (9)C85—C84—H84B110.2
C34—C33—H33120.6H84A—C84—H84B108.5
C32—C33—H33120.6C84—C85—H85A109.5
C33—C34—C35121.6 (10)C84—C85—H85B109.5
C33—C34—H34119.2H85A—C85—H85B109.5
C35—C34—H34119.2C84—C85—H85C109.5
C34—C35—C36119.8 (10)H85A—C85—H85C109.5
C34—C35—H35120.1H85B—C85—H85C109.5
C36—C35—H35120.1
O71—Cu1—P1—C21127.8 (4)P1—C21—C26—C25179.7 (8)
P2—Cu1—P1—C21110.2 (4)C41—P2—C31—C3292.8 (6)
P3—Cu1—P1—C217.8 (4)C2—P2—C31—C32160.7 (6)
O71—Cu1—P1—C1117.3 (3)Cu1—P2—C31—C3247.0 (7)
P2—Cu1—P1—C14.7 (3)C41—P2—C31—C3690.6 (8)
P3—Cu1—P1—C1122.7 (3)C2—P2—C31—C3615.9 (8)
O71—Cu1—P1—C117.0 (4)Cu1—P2—C31—C36129.6 (7)
P2—Cu1—P1—C11115.0 (3)C36—C31—C32—C330.1 (12)
P3—Cu1—P1—C11127.0 (3)P2—C31—C32—C33176.7 (6)
O71—Cu1—P2—C31111.4 (4)C31—C32—C33—C342.5 (12)
P3—Cu1—P2—C3122.5 (4)C32—C33—C34—C354.1 (15)
P1—Cu1—P2—C31134.6 (3)C33—C34—C35—C363.0 (16)
O71—Cu1—P2—C4122.0 (4)C32—C31—C36—C351.1 (13)
P3—Cu1—P2—C41155.9 (3)P2—C31—C36—C35175.3 (7)
P1—Cu1—P2—C4192.0 (3)C34—C35—C36—C310.3 (15)
O71—Cu1—P2—C2133.6 (4)C31—P2—C41—C46133.3 (8)
P3—Cu1—P2—C292.5 (3)C2—P2—C41—C46118.3 (8)
P1—Cu1—P2—C219.6 (3)Cu1—P2—C41—C466.6 (9)
O71—Cu1—P3—C358.7 (4)C31—P2—C41—C4246.7 (9)
P2—Cu1—P3—C3162.7 (3)C2—P2—C41—C4261.8 (9)
P1—Cu1—P3—C362.3 (3)Cu1—P2—C41—C42173.5 (7)
O71—Cu1—P3—C51174.5 (4)C46—C41—C42—C431.6 (16)
P2—Cu1—P3—C5146.9 (3)P2—C41—C42—C43178.5 (9)
P1—Cu1—P3—C5153.5 (3)C41—C42—C43—C442.7 (18)
O71—Cu1—P3—C6161.2 (4)C42—C43—C44—C453.5 (18)
P2—Cu1—P3—C6177.4 (3)C43—C44—C45—C463.2 (17)
P1—Cu1—P3—C61177.8 (3)C42—C41—C46—C451.2 (15)
C21—P1—C1—C291.6 (7)P2—C41—C46—C45178.8 (8)
C11—P1—C1—C2163.0 (6)C44—C45—C46—C412.0 (16)
Cu1—P1—C1—C235.3 (6)C3—P3—C51—C52164.1 (7)
P1—C1—C2—P255.8 (7)C61—P3—C51—C5259.5 (8)
C31—P2—C2—C1173.2 (6)Cu1—P3—C51—C5277.5 (7)
C41—P2—C2—C178.5 (6)C3—P3—C51—C5617.2 (9)
Cu1—P2—C2—C146.7 (6)C61—P3—C51—C56121.8 (8)
C51—P3—C3—C3i175.3 (7)Cu1—P3—C51—C56101.2 (7)
C61—P3—C3—C3i71.1 (8)C56—C51—C52—C530.0 (15)
Cu1—P3—C3—C3i63.2 (8)P3—C51—C52—C53178.7 (8)
C21—P1—C11—C16160.9 (7)C51—C52—C53—C540.1 (17)
C1—P1—C11—C1692.2 (7)C52—C53—C54—C550.6 (18)
Cu1—P1—C11—C1619.2 (8)C53—C54—C55—C561.0 (19)
C21—P1—C11—C1221.0 (8)C54—C55—C56—C510.9 (17)
C1—P1—C11—C1285.9 (8)C52—C51—C56—C550.4 (14)
Cu1—P1—C11—C12162.7 (6)P3—C51—C56—C55179.0 (8)
C16—C11—C12—C130.6 (14)C3—P3—C61—C62125.6 (7)
P1—C11—C12—C13177.4 (7)C51—P3—C61—C62127.2 (7)
C11—C12—C13—C140.7 (15)Cu1—P3—C61—C622.4 (8)
C12—C13—C14—C150.6 (15)C3—P3—C61—C6655.6 (7)
C13—C14—C15—C160.8 (15)C51—P3—C61—C6651.6 (7)
C12—C11—C16—C151.9 (13)Cu1—P3—C61—C66178.8 (5)
P1—C11—C16—C15176.2 (7)C66—C61—C62—C630.0 (12)
C14—C15—C16—C112.1 (14)P3—C61—C62—C63178.8 (7)
C1—P1—C21—C2218.0 (9)C61—C62—C63—C640.5 (14)
C11—P1—C21—C22121.5 (9)C62—C63—C64—C651.2 (14)
Cu1—P1—C21—C2295.7 (8)C63—C64—C65—C661.3 (14)
C1—P1—C21—C26165.2 (7)C64—C65—C66—C610.8 (13)
C11—P1—C21—C2661.8 (8)C62—C61—C66—C650.2 (12)
Cu1—P1—C21—C2681.1 (8)P3—C61—C66—C65179.0 (6)
C26—C21—C22—C230.3 (16)O72—C71—O71—Cu113.9 (10)
P1—C21—C22—C23177.0 (9)C72—C71—O71—Cu1164.9 (6)
C21—C22—C23—C243.5 (18)P2—Cu1—O71—C7157.8 (6)
C22—C23—C24—C254.7 (19)P3—Cu1—O71—C7179.1 (6)
C23—C24—C25—C262.2 (18)P1—Cu1—O71—C71160.5 (5)
C24—C25—C26—C211.5 (16)C81—C82—O83—C84179.6 (19)
C22—C21—C26—C252.8 (15)C82—O83—C84—C85173.4 (15)
Symmetry code: (i) x+1, y+1, z+1.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
C33—H33···O72ii0.952.433.361 (12)166
C62—H62···O720.952.473.380 (10)161
Symmetry code: (ii) x, y+1, z+1.
 

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