metal-organic compounds
[1,1′-Bis(diphenylphosphino)cobaltocenium-κ2P,P′]dichloridoplatinum(II) hexafluoridophosphate
aCollege of Chemical and Environmental Engineering, Wuhan Polytechnic University, Wuhan 430023, People's Republic of China
*Correspondence e-mail: jintaoguan@yahoo.cn
The title bimetallic compound, [PtCl2{Co(C17H14P)2}]PF6, was obtained by reaction of 1,1′-bis(diphenylphosphino)cobaltocenium hexafluoridophosphate with bis(acetonitrile)dichloridoplatinum. The PtII ion is four-coordinated in a slightly distorted square-planar environment by two P atoms of the 1,1′-bis(diphenylphosphino)cobaltocenium moiety and two Cl atoms. In the molecules are linked by weak C—H⋯F and C—H⋯Cl hydrogen bonds.
Related literature
For background to cobaltocene derivatives applied as catalysts, see: Brasse et al. (2000); Yu et al. (2007). For the structure of dichloro [1,1′-bis(diphenylphosphino)ferrocene], see: Corain et al. (1989). For 1,1′-bis(diphenylphosphino)cobaltocenium tetrafluoridoborate, see: Hou et al. (2007).
Experimental
Crystal data
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Refinement
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Data collection: SMART (Bruker, 2001); cell SAINT (Bruker, 2001); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXTL.
Supporting information
10.1107/S1600536809027925/jh2085sup1.cif
contains datablocks I, global. DOI:Structure factors: contains datablock I. DOI: 10.1107/S1600536809027925/jh2085Isup2.hkl
A mixture of 1,1'-bis(dipehnylphosphio)cobaltocenium hexafluoridophosphate (70.2 mg, 0.1 mmol) and bis(acetonitrile)dichloroplatinum (34.8 mg, 0.1 mmol) in CH2Cl2(10 ml) was stirred for 4 h. The precipitate formed was separated by filtration and washed with Et2O and water, and dried under vacuum to give an yellow powder (85.2 mg). Crystals appropriate for data collection were obtained by slow evaporation from a CH3NO2 solution at 293 K.
All H atoms were placed in geometrically idealized positions and constrained to ride on their parent atoms with C—H = 0.93 Å; with Uiso(H) = 1.2Ueq(C).
Data collection: SMART (Bruker, 2001); cell
SAINT (Bruker, 2001); data reduction: SAINT (Bruker, 2001); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXS97 (Sheldrick, 2008); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXTL (Sheldrick, 2008).Fig. 1. The molecular structure of (I), with atom labels and 50% probability displacement ellipsoids for non-H atoms. H atoms are omitted for clarity. | |
Fig. 2. Hydrogen bonding interactions in (I).H atoms not involved in hydrogen bonding have been omitted. |
[CoPt(C17H14P)2Cl2]PF6 | Z = 2 |
Mr = 968.39 | F(000) = 940 |
Triclinic, P1 | Dx = 1.909 Mg m−3 |
Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71073 Å |
a = 8.9730 (1) Å | Cell parameters from 7129 reflections |
b = 10.8770 (1) Å | θ = 2.5–27.4° |
c = 19.7670 (1) Å | µ = 5.00 mm−1 |
α = 94.9780 (1)° | T = 293 K |
β = 102.4230 (1)° | Block, yellow |
γ = 114.2320 (1)° | 0.20 × 0.10 × 0.10 mm |
V = 1684.54 (3) Å3 |
Bruker SMART CCD area-detector diffractometer | 7506 independent reflections |
Radiation source: fine-focus sealed tube | 6245 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.080 |
ϕ and ω scans | θmax = 27.5°, θmin = 1.1° |
Absorption correction: multi-scan (SADABS; Sheldrick, 2004) | h = −11→11 |
Tmin = 0.435, Tmax = 0.635 | k = −13→13 |
17964 measured reflections | l = −25→25 |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.040 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.092 | H-atom parameters constrained |
S = 1.00 | w = 1/[σ2(Fo2) + (0.0412P)2 + 0.1224P] where P = (Fo2 + 2Fc2)/3 |
7506 reflections | (Δ/σ)max = 0.027 |
424 parameters | Δρmax = 1.98 e Å−3 |
0 restraints | Δρmin = −1.19 e Å−3 |
[CoPt(C17H14P)2Cl2]PF6 | γ = 114.2320 (1)° |
Mr = 968.39 | V = 1684.54 (3) Å3 |
Triclinic, P1 | Z = 2 |
a = 8.9730 (1) Å | Mo Kα radiation |
b = 10.8770 (1) Å | µ = 5.00 mm−1 |
c = 19.7670 (1) Å | T = 293 K |
α = 94.9780 (1)° | 0.20 × 0.10 × 0.10 mm |
β = 102.4230 (1)° |
Bruker SMART CCD area-detector diffractometer | 7506 independent reflections |
Absorption correction: multi-scan (SADABS; Sheldrick, 2004) | 6245 reflections with I > 2σ(I) |
Tmin = 0.435, Tmax = 0.635 | Rint = 0.080 |
17964 measured reflections |
R[F2 > 2σ(F2)] = 0.040 | 0 restraints |
wR(F2) = 0.092 | H-atom parameters constrained |
S = 1.00 | Δρmax = 1.98 e Å−3 |
7506 reflections | Δρmin = −1.19 e Å−3 |
424 parameters |
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. |
x | y | z | Uiso*/Ueq | ||
Pt1 | 0.39843 (2) | 0.173677 (19) | 0.691223 (10) | 0.02720 (8) | |
C1 | 0.1265 (6) | 0.0476 (5) | 0.8029 (3) | 0.0310 (11) | |
C2 | 0.1575 (7) | 0.0917 (6) | 0.8766 (3) | 0.0393 (13) | |
H2 | 0.2662 | 0.1217 | 0.9124 | 0.047* | |
C3 | 0.0069 (7) | 0.0887 (6) | 0.8896 (3) | 0.0402 (14) | |
H3 | −0.0069 | 0.1162 | 0.9355 | 0.048* | |
C4 | −0.1191 (7) | 0.0395 (6) | 0.8243 (3) | 0.0385 (13) | |
H4 | −0.2358 | 0.0284 | 0.8171 | 0.046* | |
C5 | −0.0475 (6) | 0.0153 (5) | 0.7704 (3) | 0.0335 (12) | |
H5 | −0.1066 | −0.0182 | 0.7199 | 0.040* | |
C6 | 0.1783 (7) | 0.3358 (5) | 0.7545 (3) | 0.0313 (11) | |
C7 | 0.2929 (8) | 0.3902 (6) | 0.8247 (3) | 0.0453 (15) | |
H7 | 0.4113 | 0.4042 | 0.8385 | 0.054* | |
C8 | 0.2032 (11) | 0.4171 (7) | 0.8706 (4) | 0.061 (2) | |
H8 | 0.2486 | 0.4506 | 0.9218 | 0.074* | |
C9 | 0.0375 (11) | 0.3835 (7) | 0.8310 (4) | 0.060 (2) | |
H9 | −0.0523 | 0.3899 | 0.8496 | 0.072* | |
C10 | 0.0197 (8) | 0.3319 (6) | 0.7586 (3) | 0.0462 (15) | |
H10 | −0.0830 | 0.3002 | 0.7191 | 0.055* | |
C11 | 0.1492 (7) | −0.1487 (5) | 0.7122 (3) | 0.0350 (12) | |
C12 | 0.0321 (8) | −0.2418 (6) | 0.7413 (3) | 0.0507 (16) | |
H12 | 0.0269 | −0.2148 | 0.7864 | 0.061* | |
C13 | −0.0751 (8) | −0.3725 (7) | 0.7043 (4) | 0.0605 (19) | |
H13 | −0.1526 | −0.4341 | 0.7241 | 0.073* | |
C14 | −0.0672 (8) | −0.4123 (6) | 0.6369 (4) | 0.0574 (18) | |
H14 | −0.1420 | −0.5001 | 0.6109 | 0.069* | |
C15 | 0.0499 (8) | −0.3231 (7) | 0.6084 (4) | 0.0519 (16) | |
H15 | 0.0562 | −0.3515 | 0.5638 | 0.062* | |
C16 | 0.1584 (7) | −0.1917 (6) | 0.6453 (3) | 0.0409 (14) | |
H16 | 0.2376 | −0.1316 | 0.6257 | 0.049* | |
C17 | 0.4359 (7) | 0.0302 (6) | 0.8356 (3) | 0.0373 (13) | |
C18 | 0.4344 (8) | −0.0865 (7) | 0.8568 (3) | 0.0513 (16) | |
H18 | 0.3546 | −0.1725 | 0.8305 | 0.062* | |
C19 | 0.5543 (11) | −0.0755 (10) | 0.9187 (4) | 0.073 (2) | |
H19 | 0.5538 | −0.1545 | 0.9335 | 0.088* | |
C20 | 0.6699 (10) | 0.0491 (11) | 0.9567 (4) | 0.074 (3) | |
H20 | 0.7482 | 0.0555 | 0.9978 | 0.089* | |
C21 | 0.6736 (8) | 0.1670 (10) | 0.9353 (4) | 0.068 (2) | |
H21 | 0.7538 | 0.2524 | 0.9622 | 0.081* | |
C22 | 0.5600 (7) | 0.1594 (7) | 0.8746 (3) | 0.0495 (16) | |
H22 | 0.5650 | 0.2392 | 0.8594 | 0.059* | |
C23 | 0.0296 (6) | 0.1815 (5) | 0.6113 (3) | 0.0295 (11) | |
C24 | −0.0224 (7) | 0.0419 (6) | 0.5888 (3) | 0.0367 (13) | |
H24 | 0.0462 | 0.0008 | 0.6067 | 0.044* | |
C25 | −0.1782 (7) | −0.0353 (6) | 0.5390 (3) | 0.0433 (14) | |
H25 | −0.2142 | −0.1290 | 0.5245 | 0.052* | |
C26 | −0.2803 (7) | 0.0236 (7) | 0.5108 (3) | 0.0494 (17) | |
H26 | −0.3833 | −0.0292 | 0.4769 | 0.059* | |
C27 | −0.2286 (8) | 0.1602 (7) | 0.5332 (3) | 0.0497 (16) | |
H27 | −0.2978 | 0.2006 | 0.5146 | 0.060* | |
C28 | −0.0737 (7) | 0.2407 (6) | 0.5835 (3) | 0.0419 (14) | |
H28 | −0.0399 | 0.3340 | 0.5982 | 0.050* | |
C29 | 0.3237 (7) | 0.4478 (6) | 0.6492 (3) | 0.0360 (12) | |
C30 | 0.3094 (8) | 0.4536 (6) | 0.5787 (3) | 0.0458 (15) | |
H30 | 0.2458 | 0.3736 | 0.5445 | 0.055* | |
C31 | 0.3895 (9) | 0.5784 (8) | 0.5587 (4) | 0.0591 (19) | |
H31 | 0.3807 | 0.5818 | 0.5112 | 0.071* | |
C32 | 0.4826 (9) | 0.6979 (7) | 0.6099 (4) | 0.063 (2) | |
H32 | 0.5356 | 0.7819 | 0.5967 | 0.075* | |
C33 | 0.4963 (9) | 0.6918 (7) | 0.6794 (4) | 0.0629 (19) | |
H33 | 0.5592 | 0.7720 | 0.7136 | 0.075* | |
C34 | 0.4184 (8) | 0.5689 (6) | 0.6996 (3) | 0.0513 (16) | |
H34 | 0.4289 | 0.5664 | 0.7472 | 0.062* | |
Cl1 | 0.57300 (18) | 0.06097 (16) | 0.69406 (8) | 0.0458 (4) | |
Cl2 | 0.5467 (2) | 0.30193 (16) | 0.61893 (9) | 0.0502 (4) | |
Co1 | 0.08481 (9) | 0.21409 (8) | 0.82014 (4) | 0.03369 (17) | |
P1 | 0.27781 (16) | 0.02746 (14) | 0.75901 (7) | 0.0295 (3) | |
P2 | 0.23250 (16) | 0.28380 (13) | 0.67663 (7) | 0.0285 (3) | |
F1 | 0.7096 (13) | 0.6711 (9) | 0.8492 (4) | 0.209 (4) | |
F4 | 0.9060 (8) | 0.6276 (8) | 0.9842 (3) | 0.129 (2) | |
F3 | 0.6545 (11) | 0.6101 (15) | 0.9389 (5) | 0.255 (6) | |
F5 | 0.7334 (12) | 0.4950 (8) | 0.8797 (7) | 0.265 (6) | |
F2 | 0.8821 (13) | 0.7923 (8) | 0.9449 (5) | 0.230 (5) | |
F6 | 0.9614 (11) | 0.6650 (12) | 0.8885 (4) | 0.211 (5) | |
P3 | 0.8058 (3) | 0.6409 (2) | 0.91318 (10) | 0.0653 (5) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Pt1 | 0.02182 (10) | 0.02686 (12) | 0.03064 (12) | 0.00777 (8) | 0.00884 (8) | 0.00572 (8) |
C1 | 0.030 (3) | 0.028 (3) | 0.037 (3) | 0.012 (2) | 0.013 (2) | 0.012 (2) |
C2 | 0.036 (3) | 0.054 (4) | 0.029 (3) | 0.019 (3) | 0.010 (2) | 0.012 (3) |
C3 | 0.045 (3) | 0.048 (4) | 0.036 (3) | 0.022 (3) | 0.021 (3) | 0.018 (3) |
C4 | 0.032 (3) | 0.041 (3) | 0.046 (3) | 0.014 (2) | 0.017 (3) | 0.014 (3) |
C5 | 0.033 (3) | 0.032 (3) | 0.032 (3) | 0.010 (2) | 0.010 (2) | 0.005 (2) |
C6 | 0.037 (3) | 0.024 (3) | 0.035 (3) | 0.012 (2) | 0.014 (2) | 0.008 (2) |
C7 | 0.046 (3) | 0.031 (3) | 0.038 (3) | 0.001 (3) | 0.008 (3) | −0.002 (3) |
C8 | 0.094 (6) | 0.037 (4) | 0.043 (4) | 0.016 (4) | 0.028 (4) | 0.000 (3) |
C9 | 0.089 (6) | 0.057 (5) | 0.067 (5) | 0.047 (4) | 0.049 (4) | 0.020 (4) |
C10 | 0.052 (4) | 0.044 (4) | 0.059 (4) | 0.029 (3) | 0.026 (3) | 0.024 (3) |
C11 | 0.035 (3) | 0.030 (3) | 0.043 (3) | 0.016 (2) | 0.015 (2) | 0.007 (2) |
C12 | 0.060 (4) | 0.032 (3) | 0.059 (4) | 0.014 (3) | 0.030 (3) | 0.008 (3) |
C13 | 0.056 (4) | 0.042 (4) | 0.081 (5) | 0.012 (3) | 0.036 (4) | 0.010 (4) |
C14 | 0.045 (4) | 0.029 (3) | 0.085 (5) | 0.008 (3) | 0.015 (4) | −0.003 (3) |
C15 | 0.049 (4) | 0.046 (4) | 0.055 (4) | 0.017 (3) | 0.017 (3) | −0.003 (3) |
C16 | 0.034 (3) | 0.038 (3) | 0.048 (3) | 0.012 (3) | 0.014 (3) | 0.006 (3) |
C17 | 0.033 (3) | 0.055 (4) | 0.036 (3) | 0.026 (3) | 0.013 (2) | 0.018 (3) |
C18 | 0.055 (4) | 0.060 (4) | 0.057 (4) | 0.036 (3) | 0.023 (3) | 0.027 (3) |
C19 | 0.074 (5) | 0.115 (8) | 0.068 (5) | 0.064 (5) | 0.032 (4) | 0.059 (5) |
C20 | 0.052 (4) | 0.142 (9) | 0.049 (4) | 0.057 (5) | 0.018 (4) | 0.042 (5) |
C21 | 0.038 (4) | 0.111 (7) | 0.043 (4) | 0.029 (4) | 0.003 (3) | 0.005 (4) |
C22 | 0.041 (3) | 0.061 (4) | 0.047 (4) | 0.026 (3) | 0.009 (3) | 0.005 (3) |
C23 | 0.029 (3) | 0.032 (3) | 0.028 (3) | 0.014 (2) | 0.007 (2) | 0.007 (2) |
C24 | 0.034 (3) | 0.038 (3) | 0.039 (3) | 0.016 (2) | 0.011 (2) | 0.008 (2) |
C25 | 0.039 (3) | 0.035 (3) | 0.042 (3) | 0.006 (3) | 0.009 (3) | −0.006 (3) |
C26 | 0.028 (3) | 0.067 (5) | 0.040 (3) | 0.011 (3) | 0.006 (3) | −0.003 (3) |
C27 | 0.037 (3) | 0.067 (5) | 0.052 (4) | 0.033 (3) | 0.006 (3) | 0.012 (3) |
C28 | 0.038 (3) | 0.040 (3) | 0.049 (4) | 0.023 (3) | 0.007 (3) | 0.002 (3) |
C29 | 0.034 (3) | 0.032 (3) | 0.041 (3) | 0.013 (2) | 0.012 (2) | 0.012 (2) |
C30 | 0.051 (4) | 0.042 (4) | 0.048 (4) | 0.020 (3) | 0.019 (3) | 0.015 (3) |
C31 | 0.066 (4) | 0.065 (5) | 0.060 (4) | 0.032 (4) | 0.028 (4) | 0.034 (4) |
C32 | 0.058 (4) | 0.041 (4) | 0.092 (6) | 0.017 (3) | 0.029 (4) | 0.036 (4) |
C33 | 0.065 (5) | 0.034 (4) | 0.070 (5) | 0.006 (3) | 0.012 (4) | 0.010 (3) |
C34 | 0.051 (4) | 0.037 (4) | 0.050 (4) | 0.007 (3) | 0.008 (3) | 0.013 (3) |
Cl1 | 0.0384 (7) | 0.0527 (9) | 0.0572 (9) | 0.0263 (7) | 0.0193 (7) | 0.0171 (7) |
Cl2 | 0.0529 (9) | 0.0433 (9) | 0.0666 (10) | 0.0201 (7) | 0.0379 (8) | 0.0221 (7) |
Co1 | 0.0351 (4) | 0.0350 (4) | 0.0317 (4) | 0.0140 (3) | 0.0140 (3) | 0.0054 (3) |
P1 | 0.0275 (6) | 0.0304 (7) | 0.0321 (7) | 0.0127 (6) | 0.0101 (6) | 0.0091 (6) |
P2 | 0.0282 (6) | 0.0246 (7) | 0.0307 (7) | 0.0088 (5) | 0.0100 (6) | 0.0055 (5) |
F1 | 0.269 (10) | 0.196 (9) | 0.115 (5) | 0.133 (8) | −0.088 (6) | −0.008 (5) |
F4 | 0.119 (5) | 0.172 (6) | 0.091 (4) | 0.062 (4) | 0.013 (3) | 0.053 (4) |
F3 | 0.122 (6) | 0.457 (19) | 0.210 (9) | 0.118 (9) | 0.102 (7) | 0.085 (10) |
F5 | 0.172 (8) | 0.088 (6) | 0.445 (17) | 0.039 (5) | −0.002 (10) | −0.082 (8) |
F2 | 0.255 (11) | 0.105 (6) | 0.217 (9) | 0.073 (6) | −0.119 (8) | −0.031 (6) |
F6 | 0.165 (7) | 0.350 (15) | 0.138 (6) | 0.101 (8) | 0.091 (6) | 0.074 (8) |
P3 | 0.0571 (11) | 0.0653 (14) | 0.0542 (11) | 0.0153 (10) | 0.0056 (9) | 0.0014 (10) |
Pt1—P2 | 2.2525 (14) | C15—H15 | 0.9300 |
Pt1—P1 | 2.2533 (13) | C16—H16 | 0.9300 |
Pt1—Cl2 | 2.3235 (13) | C17—C18 | 1.366 (8) |
Pt1—Cl1 | 2.3473 (15) | C17—C22 | 1.403 (8) |
C1—C2 | 1.424 (7) | C17—P1 | 1.828 (5) |
C1—C5 | 1.432 (7) | C18—C19 | 1.403 (9) |
C1—P1 | 1.833 (5) | C18—H18 | 0.9300 |
C1—Co1 | 2.010 (5) | C19—C20 | 1.346 (12) |
C2—C3 | 1.416 (8) | C19—H19 | 0.9300 |
C2—Co1 | 2.025 (6) | C20—C21 | 1.374 (11) |
C2—H2 | 0.9800 | C20—H20 | 0.9300 |
C3—C4 | 1.409 (8) | C21—C22 | 1.367 (9) |
C3—Co1 | 2.046 (5) | C21—H21 | 0.9300 |
C3—H3 | 0.9800 | C22—H22 | 0.9300 |
C4—C5 | 1.415 (7) | C23—C28 | 1.381 (8) |
C4—Co1 | 2.049 (5) | C23—C24 | 1.390 (8) |
C4—H4 | 0.9800 | C23—P2 | 1.816 (5) |
C5—Co1 | 2.018 (5) | C24—C25 | 1.388 (8) |
C5—H5 | 0.9800 | C24—H24 | 0.9300 |
C6—C10 | 1.426 (8) | C25—C26 | 1.373 (9) |
C6—C7 | 1.441 (8) | C25—H25 | 0.9300 |
C6—P2 | 1.823 (5) | C26—C27 | 1.361 (9) |
C6—Co1 | 1.999 (5) | C26—H26 | 0.9300 |
C7—C8 | 1.420 (9) | C27—C28 | 1.394 (8) |
C7—Co1 | 2.032 (5) | C27—H27 | 0.9300 |
C7—H7 | 0.9800 | C28—H28 | 0.9300 |
C8—C9 | 1.400 (10) | C29—C30 | 1.381 (8) |
C8—Co1 | 2.058 (6) | C29—C34 | 1.391 (8) |
C8—H8 | 0.9800 | C29—P2 | 1.818 (5) |
C9—C10 | 1.441 (9) | C30—C31 | 1.390 (9) |
C9—Co1 | 2.057 (7) | C30—H30 | 0.9300 |
C9—H9 | 0.9800 | C31—C32 | 1.389 (10) |
C10—Co1 | 2.011 (6) | C31—H31 | 0.9300 |
C10—H10 | 0.9800 | C32—C33 | 1.364 (9) |
C11—C16 | 1.394 (7) | C32—H32 | 0.9300 |
C11—C12 | 1.396 (7) | C33—C34 | 1.372 (8) |
C11—P1 | 1.810 (6) | C33—H33 | 0.9300 |
C12—C13 | 1.369 (9) | C34—H34 | 0.9300 |
C12—H12 | 0.9300 | F1—P3 | 1.512 (7) |
C13—C14 | 1.392 (9) | F4—P3 | 1.550 (6) |
C13—H13 | 0.9300 | F3—P3 | 1.472 (7) |
C14—C15 | 1.369 (9) | F5—P3 | 1.472 (8) |
C14—H14 | 0.9300 | F2—P3 | 1.511 (8) |
C15—C16 | 1.377 (8) | F6—P3 | 1.507 (7) |
P2—Pt1—P1 | 100.63 (5) | C25—C24—C23 | 119.1 (5) |
P2—Pt1—Cl2 | 88.81 (5) | C25—C24—H24 | 120.5 |
P1—Pt1—Cl2 | 170.32 (5) | C23—C24—H24 | 120.5 |
P2—Pt1—Cl1 | 173.88 (5) | C26—C25—C24 | 121.5 (6) |
P1—Pt1—Cl1 | 84.37 (5) | C26—C25—H25 | 119.3 |
Cl2—Pt1—Cl1 | 86.08 (5) | C24—C25—H25 | 119.3 |
C2—C1—C5 | 106.8 (4) | C27—C26—C25 | 119.1 (6) |
C2—C1—P1 | 126.3 (4) | C27—C26—H26 | 120.5 |
C5—C1—P1 | 126.8 (4) | C25—C26—H26 | 120.5 |
C2—C1—Co1 | 69.9 (3) | C26—C27—C28 | 121.0 (6) |
C5—C1—Co1 | 69.5 (3) | C26—C27—H27 | 119.5 |
P1—C1—Co1 | 128.0 (3) | C28—C27—H27 | 119.5 |
C3—C2—C1 | 108.9 (5) | C23—C28—C27 | 119.8 (6) |
C3—C2—Co1 | 70.4 (3) | C23—C28—H28 | 120.1 |
C1—C2—Co1 | 68.8 (3) | C27—C28—H28 | 120.1 |
C3—C2—H2 | 125.5 | C30—C29—C34 | 118.9 (5) |
C1—C2—H2 | 125.5 | C30—C29—P2 | 120.7 (4) |
Co1—C2—H2 | 125.5 | C34—C29—P2 | 120.2 (4) |
C4—C3—C2 | 107.5 (5) | C29—C30—C31 | 120.3 (6) |
C4—C3—Co1 | 70.0 (3) | C29—C30—H30 | 119.8 |
C2—C3—Co1 | 68.9 (3) | C31—C30—H30 | 119.8 |
C4—C3—H3 | 126.3 | C32—C31—C30 | 119.7 (6) |
C2—C3—H3 | 126.3 | C32—C31—H31 | 120.2 |
Co1—C3—H3 | 126.3 | C30—C31—H31 | 120.2 |
C3—C4—C5 | 109.0 (5) | C33—C32—C31 | 119.8 (6) |
C3—C4—Co1 | 69.7 (3) | C33—C32—H32 | 120.1 |
C5—C4—Co1 | 68.5 (3) | C31—C32—H32 | 120.1 |
C3—C4—H4 | 125.5 | C32—C33—C34 | 120.8 (7) |
C5—C4—H4 | 125.5 | C32—C33—H33 | 119.6 |
Co1—C4—H4 | 125.5 | C34—C33—H33 | 119.6 |
C4—C5—C1 | 107.8 (5) | C33—C34—C29 | 120.4 (6) |
C4—C5—Co1 | 70.8 (3) | C33—C34—H34 | 119.8 |
C1—C5—Co1 | 68.9 (3) | C29—C34—H34 | 119.8 |
C4—C5—H5 | 126.1 | C6—Co1—C1 | 107.7 (2) |
C1—C5—H5 | 126.1 | C6—Co1—C10 | 41.7 (2) |
Co1—C5—H5 | 126.1 | C1—Co1—C10 | 134.9 (2) |
C10—C6—C7 | 107.2 (5) | C6—Co1—C5 | 111.5 (2) |
C10—C6—P2 | 127.8 (4) | C1—Co1—C5 | 41.7 (2) |
C7—C6—P2 | 125.0 (4) | C10—Co1—C5 | 109.1 (2) |
C10—C6—Co1 | 69.6 (3) | C6—Co1—C2 | 134.9 (2) |
C7—C6—Co1 | 70.3 (3) | C1—Co1—C2 | 41.3 (2) |
P2—C6—Co1 | 125.5 (3) | C10—Co1—C2 | 175.8 (2) |
C8—C7—C6 | 108.0 (6) | C5—Co1—C2 | 69.1 (2) |
C8—C7—Co1 | 70.7 (4) | C6—Co1—C7 | 41.9 (2) |
C6—C7—Co1 | 67.8 (3) | C1—Co1—C7 | 111.7 (2) |
C8—C7—H7 | 126.0 | C10—Co1—C7 | 69.6 (3) |
C6—C7—H7 | 126.0 | C5—Co1—C7 | 142.6 (2) |
Co1—C7—H7 | 126.0 | C2—Co1—C7 | 109.3 (3) |
C9—C8—C7 | 108.8 (6) | C6—Co1—C3 | 175.5 (2) |
C9—C8—Co1 | 70.1 (4) | C1—Co1—C3 | 69.5 (2) |
C7—C8—Co1 | 68.7 (3) | C10—Co1—C3 | 142.8 (2) |
C9—C8—H8 | 125.6 | C5—Co1—C3 | 68.9 (2) |
C7—C8—H8 | 125.6 | C2—Co1—C3 | 40.7 (2) |
Co1—C8—H8 | 125.6 | C7—Co1—C3 | 135.3 (2) |
C8—C9—C10 | 108.2 (6) | C6—Co1—C4 | 142.7 (2) |
C8—C9—Co1 | 70.1 (4) | C1—Co1—C4 | 69.0 (2) |
C10—C9—Co1 | 67.5 (3) | C10—Co1—C4 | 113.4 (2) |
C8—C9—H9 | 125.9 | C5—Co1—C4 | 40.7 (2) |
C10—C9—H9 | 125.9 | C2—Co1—C4 | 68.0 (2) |
Co1—C9—H9 | 125.9 | C7—Co1—C4 | 175.4 (2) |
C6—C10—C9 | 107.8 (6) | C3—Co1—C4 | 40.2 (2) |
C6—C10—Co1 | 68.7 (3) | C6—Co1—C9 | 69.7 (2) |
C9—C10—Co1 | 71.0 (4) | C1—Co1—C9 | 176.4 (2) |
C6—C10—H10 | 126.1 | C10—Co1—C9 | 41.5 (3) |
C9—C10—H10 | 126.1 | C5—Co1—C9 | 136.4 (3) |
Co1—C10—H10 | 126.1 | C2—Co1—C9 | 142.3 (3) |
C16—C11—C12 | 119.0 (5) | C7—Co1—C9 | 68.2 (3) |
C16—C11—P1 | 120.9 (4) | C3—Co1—C9 | 113.3 (2) |
C12—C11—P1 | 120.0 (4) | C4—Co1—C9 | 111.4 (3) |
C13—C12—C11 | 120.8 (6) | C6—Co1—C8 | 69.6 (2) |
C13—C12—H12 | 119.6 | C1—Co1—C8 | 142.3 (3) |
C11—C12—H12 | 119.6 | C10—Co1—C8 | 68.9 (3) |
C12—C13—C14 | 119.4 (6) | C5—Co1—C8 | 175.9 (3) |
C12—C13—H13 | 120.3 | C2—Co1—C8 | 113.2 (3) |
C14—C13—H13 | 120.3 | C7—Co1—C8 | 40.6 (2) |
C15—C14—C13 | 120.4 (6) | C3—Co1—C8 | 110.4 (2) |
C15—C14—H14 | 119.8 | C4—Co1—C8 | 136.2 (2) |
C13—C14—H14 | 119.8 | C9—Co1—C8 | 39.8 (3) |
C14—C15—C16 | 120.5 (6) | C11—P1—C17 | 108.6 (3) |
C14—C15—H15 | 119.8 | C11—P1—C1 | 98.9 (2) |
C16—C15—H15 | 119.8 | C17—P1—C1 | 99.8 (2) |
C15—C16—C11 | 119.9 (5) | C11—P1—Pt1 | 114.09 (18) |
C15—C16—H16 | 120.0 | C17—P1—Pt1 | 111.89 (17) |
C11—C16—H16 | 120.0 | C1—P1—Pt1 | 121.89 (17) |
C18—C17—C22 | 119.8 (6) | C23—P2—C29 | 105.9 (2) |
C18—C17—P1 | 123.0 (5) | C23—P2—C6 | 104.9 (2) |
C22—C17—P1 | 117.2 (5) | C29—P2—C6 | 100.4 (2) |
C17—C18—C19 | 119.5 (7) | C23—P2—Pt1 | 112.19 (18) |
C17—C18—H18 | 120.2 | C29—P2—Pt1 | 115.15 (18) |
C19—C18—H18 | 120.2 | C6—P2—Pt1 | 116.92 (18) |
C20—C19—C18 | 120.1 (8) | F5—P3—F3 | 89.2 (7) |
C20—C19—H19 | 119.9 | F5—P3—F6 | 88.5 (6) |
C18—C19—H19 | 119.9 | F3—P3—F6 | 176.5 (7) |
C19—C20—C21 | 120.8 (7) | F5—P3—F2 | 177.7 (7) |
C19—C20—H20 | 119.6 | F3—P3—F2 | 92.5 (7) |
C21—C20—H20 | 119.6 | F6—P3—F2 | 89.9 (6) |
C22—C21—C20 | 120.4 (8) | F5—P3—F1 | 91.4 (6) |
C22—C21—H21 | 119.8 | F3—P3—F1 | 86.0 (6) |
C20—C21—H21 | 119.8 | F6—P3—F1 | 96.7 (6) |
C21—C22—C17 | 119.4 (7) | F2—P3—F1 | 87.1 (5) |
C21—C22—H22 | 120.3 | F5—P3—F4 | 95.7 (6) |
C17—C22—H22 | 120.3 | F3—P3—F4 | 91.4 (5) |
C28—C23—C24 | 119.5 (5) | F6—P3—F4 | 86.2 (4) |
C28—C23—P2 | 120.8 (4) | F2—P3—F4 | 85.9 (4) |
C24—C23—P2 | 119.7 (4) | F1—P3—F4 | 172.4 (5) |
C5—C1—C2—C3 | −0.8 (6) | C3—C2—Co1—C1 | −120.5 (5) |
P1—C1—C2—C3 | −177.8 (4) | C3—C2—Co1—C10 | −147 (3) |
Co1—C1—C2—C3 | 59.1 (4) | C1—C2—Co1—C10 | −27 (4) |
C5—C1—C2—Co1 | −59.9 (3) | C3—C2—Co1—C5 | −81.5 (4) |
P1—C1—C2—Co1 | 123.0 (4) | C1—C2—Co1—C5 | 39.0 (3) |
C1—C2—C3—C4 | 1.5 (7) | C3—C2—Co1—C7 | 138.4 (4) |
Co1—C2—C3—C4 | 59.6 (4) | C1—C2—Co1—C7 | −101.2 (3) |
C1—C2—C3—Co1 | −58.1 (4) | C1—C2—Co1—C3 | 120.5 (5) |
C2—C3—C4—C5 | −1.6 (7) | C3—C2—Co1—C4 | −37.6 (3) |
Co1—C3—C4—C5 | 57.3 (4) | C1—C2—Co1—C4 | 82.9 (3) |
C2—C3—C4—Co1 | −58.9 (4) | C3—C2—Co1—C9 | 59.3 (6) |
C3—C4—C5—C1 | 1.1 (6) | C1—C2—Co1—C9 | 179.7 (4) |
Co1—C4—C5—C1 | 59.2 (3) | C3—C2—Co1—C8 | 94.8 (4) |
C3—C4—C5—Co1 | −58.1 (4) | C1—C2—Co1—C8 | −144.7 (3) |
C2—C1—C5—C4 | −0.2 (6) | C8—C7—Co1—C6 | 119.8 (6) |
P1—C1—C5—C4 | 176.8 (4) | C8—C7—Co1—C1 | −147.6 (4) |
Co1—C1—C5—C4 | −60.4 (4) | C6—C7—Co1—C1 | 92.7 (4) |
C2—C1—C5—Co1 | 60.2 (4) | C8—C7—Co1—C10 | 80.9 (5) |
P1—C1—C5—Co1 | −122.8 (4) | C6—C7—Co1—C10 | −38.8 (3) |
C10—C6—C7—C8 | 0.7 (6) | C8—C7—Co1—C5 | 176.0 (4) |
P2—C6—C7—C8 | −179.6 (4) | C6—C7—Co1—C5 | 56.2 (5) |
Co1—C6—C7—C8 | −59.5 (4) | C8—C7—Co1—C2 | −103.4 (4) |
C10—C6—C7—Co1 | 60.1 (4) | C6—C7—Co1—C2 | 136.8 (3) |
P2—C6—C7—Co1 | −120.1 (4) | C8—C7—Co1—C3 | −65.3 (6) |
C6—C7—C8—C9 | −1.0 (7) | C6—C7—Co1—C3 | 174.9 (3) |
Co1—C7—C8—C9 | −58.7 (5) | C8—C7—Co1—C4 | −50 (3) |
C6—C7—C8—Co1 | 57.7 (4) | C6—C7—Co1—C4 | −170 (3) |
C7—C8—C9—C10 | 1.0 (8) | C8—C7—Co1—C9 | 36.4 (4) |
Co1—C8—C9—C10 | −56.9 (5) | C6—C7—Co1—C9 | −83.4 (4) |
C7—C8—C9—Co1 | 57.9 (5) | C6—C7—Co1—C8 | −119.8 (6) |
C7—C6—C10—C9 | −0.1 (6) | C4—C3—Co1—C6 | −132 (3) |
P2—C6—C10—C9 | −179.8 (4) | C2—C3—Co1—C6 | −14 (3) |
Co1—C6—C10—C9 | 60.5 (4) | C4—C3—Co1—C1 | −81.5 (4) |
C7—C6—C10—Co1 | −60.6 (4) | C2—C3—Co1—C1 | 37.4 (3) |
P2—C6—C10—Co1 | 119.7 (4) | C4—C3—Co1—C10 | 57.4 (6) |
C8—C9—C10—C6 | −0.6 (7) | C2—C3—Co1—C10 | 176.2 (4) |
Co1—C9—C10—C6 | −59.0 (4) | C4—C3—Co1—C5 | −36.7 (3) |
C8—C9—C10—Co1 | 58.5 (5) | C2—C3—Co1—C5 | 82.1 (4) |
C16—C11—C12—C13 | −1.5 (10) | C4—C3—Co1—C2 | −118.9 (5) |
P1—C11—C12—C13 | 175.0 (6) | C4—C3—Co1—C7 | 178.1 (4) |
C11—C12—C13—C14 | −0.2 (11) | C2—C3—Co1—C7 | −63.0 (5) |
C12—C13—C14—C15 | 1.8 (11) | C2—C3—Co1—C4 | 118.9 (5) |
C13—C14—C15—C16 | −1.7 (11) | C4—C3—Co1—C9 | 96.0 (4) |
C14—C15—C16—C11 | 0.0 (10) | C2—C3—Co1—C9 | −145.1 (4) |
C12—C11—C16—C15 | 1.6 (9) | C4—C3—Co1—C8 | 138.9 (4) |
P1—C11—C16—C15 | −174.9 (5) | C2—C3—Co1—C8 | −102.2 (4) |
C22—C17—C18—C19 | 1.9 (9) | C3—C4—Co1—C6 | 174.5 (4) |
P1—C17—C18—C19 | −176.2 (5) | C5—C4—Co1—C6 | 53.3 (5) |
C17—C18—C19—C20 | −0.1 (10) | C3—C4—Co1—C1 | 82.6 (4) |
C18—C19—C20—C21 | −0.7 (11) | C5—C4—Co1—C1 | −38.6 (3) |
C19—C20—C21—C22 | −0.4 (11) | C3—C4—Co1—C10 | −146.3 (4) |
C20—C21—C22—C17 | 2.1 (10) | C5—C4—Co1—C10 | 92.5 (4) |
C18—C17—C22—C21 | −2.9 (9) | C3—C4—Co1—C5 | 121.2 (5) |
P1—C17—C22—C21 | 175.3 (5) | C3—C4—Co1—C2 | 38.0 (3) |
C28—C23—C24—C25 | −0.5 (8) | C5—C4—Co1—C2 | −83.2 (4) |
P2—C23—C24—C25 | 179.7 (4) | C3—C4—Co1—C7 | −17 (3) |
C23—C24—C25—C26 | 1.2 (8) | C5—C4—Co1—C7 | −138 (3) |
C24—C25—C26—C27 | −1.3 (9) | C5—C4—Co1—C3 | −121.2 (5) |
C25—C26—C27—C28 | 0.7 (9) | C3—C4—Co1—C9 | −101.3 (4) |
C24—C23—C28—C27 | 0.0 (8) | C5—C4—Co1—C9 | 137.5 (4) |
P2—C23—C28—C27 | 179.8 (4) | C3—C4—Co1—C8 | −63.0 (5) |
C26—C27—C28—C23 | −0.1 (9) | C5—C4—Co1—C8 | 175.9 (4) |
C34—C29—C30—C31 | 0.5 (9) | C8—C9—Co1—C6 | −82.1 (4) |
P2—C29—C30—C31 | −175.5 (5) | C10—C9—Co1—C6 | 38.4 (4) |
C29—C30—C31—C32 | −0.8 (10) | C8—C9—Co1—C1 | −126 (4) |
C30—C31—C32—C33 | 0.7 (11) | C10—C9—Co1—C1 | −5 (4) |
C31—C32—C33—C34 | −0.3 (12) | C8—C9—Co1—C10 | −120.5 (6) |
C32—C33—C34—C29 | 0.0 (11) | C8—C9—Co1—C5 | 177.6 (3) |
C30—C29—C34—C33 | −0.1 (10) | C10—C9—Co1—C5 | −61.9 (5) |
P2—C29—C34—C33 | 175.9 (5) | C8—C9—Co1—C2 | 56.6 (6) |
C10—C6—Co1—C1 | 139.1 (4) | C10—C9—Co1—C2 | 177.2 (4) |
C7—C6—Co1—C1 | −103.0 (4) | C8—C9—Co1—C7 | −37.1 (4) |
P2—C6—Co1—C1 | 16.5 (4) | C10—C9—Co1—C7 | 83.4 (4) |
C7—C6—Co1—C10 | 117.9 (5) | C8—C9—Co1—C3 | 94.3 (4) |
P2—C6—Co1—C10 | −122.6 (5) | C10—C9—Co1—C3 | −145.2 (4) |
C10—C6—Co1—C5 | 95.0 (4) | C8—C9—Co1—C4 | 137.9 (4) |
C7—C6—Co1—C5 | −147.2 (4) | C10—C9—Co1—C4 | −101.6 (4) |
P2—C6—Co1—C5 | −27.6 (4) | C10—C9—Co1—C8 | 120.5 (6) |
C10—C6—Co1—C2 | 176.4 (4) | C9—C8—Co1—C6 | 82.4 (4) |
C7—C6—Co1—C2 | −65.7 (5) | C7—C8—Co1—C6 | −38.2 (4) |
P2—C6—Co1—C2 | 53.8 (5) | C9—C8—Co1—C1 | 175.2 (3) |
C10—C6—Co1—C7 | −117.9 (5) | C7—C8—Co1—C1 | 54.6 (6) |
P2—C6—Co1—C7 | 119.5 (5) | C9—C8—Co1—C10 | 37.7 (4) |
C10—C6—Co1—C3 | −171 (3) | C7—C8—Co1—C10 | −82.9 (4) |
C7—C6—Co1—C3 | −53 (3) | C9—C8—Co1—C5 | −24 (3) |
P2—C6—Co1—C3 | 66 (3) | C7—C8—Co1—C5 | −144 (3) |
C10—C6—Co1—C4 | 60.7 (5) | C9—C8—Co1—C2 | −146.3 (4) |
C7—C6—Co1—C4 | 178.6 (4) | C7—C8—Co1—C2 | 93.1 (4) |
P2—C6—Co1—C4 | −61.8 (5) | C9—C8—Co1—C7 | 120.6 (6) |
C10—C6—Co1—C9 | −38.2 (4) | C9—C8—Co1—C3 | −102.4 (4) |
C7—C6—Co1—C9 | 79.6 (4) | C7—C8—Co1—C3 | 137.0 (4) |
P2—C6—Co1—C9 | −160.8 (5) | C9—C8—Co1—C4 | −64.5 (5) |
C10—C6—Co1—C8 | −80.8 (4) | C7—C8—Co1—C4 | 174.9 (4) |
C7—C6—Co1—C8 | 37.1 (4) | C7—C8—Co1—C9 | −120.6 (6) |
P2—C6—Co1—C8 | 156.6 (5) | C16—C11—P1—C17 | −111.8 (5) |
C2—C1—Co1—C6 | 139.5 (3) | C12—C11—P1—C17 | 71.7 (5) |
C5—C1—Co1—C6 | −102.8 (3) | C16—C11—P1—C1 | 144.6 (5) |
P1—C1—Co1—C6 | 18.6 (4) | C12—C11—P1—C1 | −31.8 (6) |
C2—C1—Co1—C10 | 177.4 (3) | C16—C11—P1—Pt1 | 13.7 (5) |
C5—C1—Co1—C10 | −64.9 (4) | C12—C11—P1—Pt1 | −162.8 (5) |
P1—C1—Co1—C10 | 56.4 (5) | C18—C17—P1—C11 | −8.5 (5) |
C2—C1—Co1—C5 | −117.8 (4) | C22—C17—P1—C11 | 173.3 (4) |
P1—C1—Co1—C5 | 121.3 (5) | C18—C17—P1—C1 | 94.4 (5) |
C5—C1—Co1—C2 | 117.8 (4) | C22—C17—P1—C1 | −83.8 (4) |
P1—C1—Co1—C2 | −120.9 (5) | C18—C17—P1—Pt1 | −135.3 (4) |
C2—C1—Co1—C7 | 95.0 (3) | C22—C17—P1—Pt1 | 46.5 (5) |
C5—C1—Co1—C7 | −147.2 (3) | C2—C1—P1—C11 | 126.1 (5) |
P1—C1—Co1—C7 | −25.9 (4) | C5—C1—P1—C11 | −50.4 (5) |
C2—C1—Co1—C3 | −36.9 (3) | Co1—C1—P1—C11 | −142.0 (4) |
C5—C1—Co1—C3 | 80.9 (3) | C2—C1—P1—C17 | 15.4 (5) |
P1—C1—Co1—C3 | −157.8 (4) | C5—C1—P1—C17 | −161.1 (5) |
C2—C1—Co1—C4 | −80.0 (3) | Co1—C1—P1—C17 | 107.2 (4) |
C5—C1—Co1—C4 | 37.7 (3) | C2—C1—P1—Pt1 | −108.2 (5) |
P1—C1—Co1—C4 | 159.1 (4) | C5—C1—P1—Pt1 | 75.3 (5) |
C2—C1—Co1—C9 | −178 (4) | Co1—C1—P1—Pt1 | −16.3 (4) |
C5—C1—Co1—C9 | −60 (4) | P2—Pt1—P1—C11 | 104.7 (2) |
P1—C1—Co1—C9 | 62 (4) | Cl2—Pt1—P1—C11 | −62.6 (4) |
C2—C1—Co1—C8 | 60.2 (5) | Cl1—Pt1—P1—C11 | −71.8 (2) |
C5—C1—Co1—C8 | 178.0 (4) | P2—Pt1—P1—C17 | −131.6 (2) |
P1—C1—Co1—C8 | −60.7 (5) | Cl2—Pt1—P1—C17 | 61.1 (4) |
C9—C10—Co1—C6 | −118.8 (6) | Cl1—Pt1—P1—C17 | 51.9 (2) |
C6—C10—Co1—C1 | −61.7 (5) | P2—Pt1—P1—C1 | −13.8 (2) |
C9—C10—Co1—C1 | 179.5 (4) | Cl2—Pt1—P1—C1 | 178.9 (3) |
C6—C10—Co1—C5 | −101.2 (3) | Cl1—Pt1—P1—C1 | 169.7 (2) |
C9—C10—Co1—C5 | 140.0 (4) | C28—C23—P2—C29 | −39.1 (5) |
C6—C10—Co1—C2 | −37 (4) | C24—C23—P2—C29 | 140.6 (4) |
C9—C10—Co1—C2 | −156 (3) | C28—C23—P2—C6 | 66.5 (5) |
C6—C10—Co1—C7 | 39.0 (3) | C24—C23—P2—C6 | −113.7 (4) |
C9—C10—Co1—C7 | −79.8 (4) | C28—C23—P2—Pt1 | −165.6 (4) |
C6—C10—Co1—C3 | 178.9 (4) | C24—C23—P2—Pt1 | 14.2 (4) |
C9—C10—Co1—C3 | 60.0 (6) | C30—C29—P2—C23 | −39.7 (5) |
C6—C10—Co1—C4 | −144.8 (3) | C34—C29—P2—C23 | 144.4 (5) |
C9—C10—Co1—C4 | 96.4 (4) | C30—C29—P2—C6 | −148.6 (5) |
C6—C10—Co1—C9 | 118.8 (6) | C34—C29—P2—C6 | 35.5 (5) |
C6—C10—Co1—C8 | 82.6 (4) | C30—C29—P2—Pt1 | 84.9 (5) |
C9—C10—Co1—C8 | −36.2 (4) | C34—C29—P2—Pt1 | −91.0 (5) |
C4—C5—Co1—C6 | −148.5 (3) | C10—C6—P2—C23 | −15.8 (5) |
C1—C5—Co1—C6 | 92.7 (3) | C7—C6—P2—C23 | 164.4 (4) |
C4—C5—Co1—C1 | 118.8 (4) | Co1—C6—P2—C23 | 74.8 (4) |
C4—C5—Co1—C10 | −104.0 (4) | C10—C6—P2—C29 | 93.9 (5) |
C1—C5—Co1—C10 | 137.3 (3) | C7—C6—P2—C29 | −85.8 (5) |
C4—C5—Co1—C2 | 80.1 (3) | Co1—C6—P2—C29 | −175.4 (3) |
C1—C5—Co1—C2 | −38.7 (3) | C10—C6—P2—Pt1 | −140.8 (4) |
C4—C5—Co1—C7 | 174.9 (4) | C7—C6—P2—Pt1 | 39.4 (5) |
C1—C5—Co1—C7 | 56.1 (5) | Co1—C6—P2—Pt1 | −50.2 (4) |
C4—C5—Co1—C3 | 36.3 (3) | P1—Pt1—P2—C23 | −77.79 (17) |
C1—C5—Co1—C3 | −82.5 (3) | Cl2—Pt1—P2—C23 | 100.09 (17) |
C1—C5—Co1—C4 | −118.8 (4) | Cl1—Pt1—P2—C23 | 66.8 (5) |
C4—C5—Co1—C9 | −65.8 (4) | P1—Pt1—P2—C29 | 160.9 (2) |
C1—C5—Co1—C9 | 175.4 (3) | Cl2—Pt1—P2—C29 | −21.2 (2) |
C4—C5—Co1—C8 | −44 (3) | Cl1—Pt1—P2—C29 | −54.4 (5) |
C1—C5—Co1—C8 | −163 (3) | P1—Pt1—P2—C6 | 43.48 (19) |
C3—C2—Co1—C6 | 178.5 (3) | Cl2—Pt1—P2—C6 | −138.64 (19) |
C1—C2—Co1—C6 | −61.0 (4) | Cl1—Pt1—P2—C6 | −171.9 (5) |
D—H···A | D—H | H···A | D···A | D—H···A |
C3—H3···F2i | 0.98 | 2.32 | 3.190 (11) | 148 |
C4—H4···Cl1ii | 0.98 | 2.80 | 3.448 (7) | 124 |
C7—H7···F5 | 0.98 | 2.55 | 3.513 (14) | 168 |
C12—H12···F6iii | 0.93 | 2.54 | 3.267 (11) | 135 |
C14—H14···Cl2iii | 0.93 | 2.79 | 3.497 (8) | 134 |
C16—H16···Cl1 | 0.93 | 2.80 | 3.454 (7) | 128 |
C22—H22···F5 | 0.93 | 2.51 | 3.311 (11) | 145 |
Symmetry codes: (i) −x+1, −y+1, −z+2; (ii) x−1, y, z; (iii) x−1, y−1, z. |
Experimental details
Crystal data | |
Chemical formula | [CoPt(C17H14P)2Cl2]PF6 |
Mr | 968.39 |
Crystal system, space group | Triclinic, P1 |
Temperature (K) | 293 |
a, b, c (Å) | 8.9730 (1), 10.8770 (1), 19.7670 (1) |
α, β, γ (°) | 94.9780 (1), 102.4230 (1), 114.2320 (1) |
V (Å3) | 1684.54 (3) |
Z | 2 |
Radiation type | Mo Kα |
µ (mm−1) | 5.00 |
Crystal size (mm) | 0.20 × 0.10 × 0.10 |
Data collection | |
Diffractometer | Bruker SMART CCD area-detector diffractometer |
Absorption correction | Multi-scan (SADABS; Sheldrick, 2004) |
Tmin, Tmax | 0.435, 0.635 |
No. of measured, independent and observed [I > 2σ(I)] reflections | 17964, 7506, 6245 |
Rint | 0.080 |
(sin θ/λ)max (Å−1) | 0.650 |
Refinement | |
R[F2 > 2σ(F2)], wR(F2), S | 0.040, 0.092, 1.00 |
No. of reflections | 7506 |
No. of parameters | 424 |
H-atom treatment | H-atom parameters constrained |
Δρmax, Δρmin (e Å−3) | 1.98, −1.19 |
Computer programs: SMART (Bruker, 2001), SAINT (Bruker, 2001), SHELXS97 (Sheldrick, 2008), SHELXTL (Sheldrick, 2008).
D—H···A | D—H | H···A | D···A | D—H···A |
C3—H3···F2i | 0.98 | 2.32 | 3.190 (11) | 148 |
C4—H4···Cl1ii | 0.98 | 2.80 | 3.448 (7) | 124 |
C7—H7···F5 | 0.98 | 2.55 | 3.513 (14) | 168 |
C12—H12···F6iii | 0.93 | 2.54 | 3.267 (11) | 135 |
C14—H14···Cl2iii | 0.93 | 2.79 | 3.497 (8) | 134 |
C16—H16···Cl1 | 0.93 | 2.80 | 3.454 (7) | 128 |
C22—H22···F5 | 0.93 | 2.51 | 3.311 (11) | 145 |
Symmetry codes: (i) −x+1, −y+1, −z+2; (ii) x−1, y, z; (iii) x−1, y−1, z. |
Acknowledgements
The authors acknowledge financial support from the National Natural Science Foundation of China (No. 20572029), the New Century Excellent Talents in Universities (NCET-04–0743) and the Cultivation Fund of the Key Scientific and Technical Innovation Project, Ministry of Education of China (No. 705039).
References
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Cobaltocene derivatives have been applied as catalysts in cross-coupling reactions (Brasse et al., 2000). As part of our investigations of new catalysts, we have focused our attention on cobaltocenium compounds. Some complexes, such as 1,1'-bis(diphenylphosphino)cobaltocenium tetrafluoridoborate, have been obtained and reported(Hou et al., 2007). Herein, we report the structure of the title compound, (I) (Fig. 1), which is very similar to the complex dichloro [1,1'-bis(diphenylphosphino)ferrocene] (Corain et al., 1989). The PtÎI^ metal ion is in an essentially square-planar environment defined by the two Cl atoms and the two P atoms. The angle between the plane P—Pt—P and the plane Cl—Pt—Cl is 4.0 (3)°. The bond angle of the two P atoms at the Pt atom is 100.64 (5)°, with the two Cl atoms it is 86.08 (5)°. The two substituted Cp rings are staggered and are essentially parallel with an interplanar angle of 3.62 (2)°. The crystal structure contains non-bonded C—H···F and C—H···Cl interactions (Fig.2).