Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806016540/sj2059sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536806016540/sj2059Isup2.hkl |
CCDC reference: 610898
Key indicators
- Single-crystal X-ray study
- T = 297 K
- Mean (C-C) = 0.007 Å
- R factor = 0.031
- wR factor = 0.071
- Data-to-parameter ratio = 24.4
checkCIF/PLATON results
No syntax errors found
Alert level C PLAT066_ALERT_1_C Predicted and Reported Transmissions Identical . ? PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.01 Ratio PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C17B PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........ 14
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 4 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 ALERT type 2 Indicator that the structure model may be wrong or deficient 0 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion
Data collection: APEX2 (Bruker, 2005); cell refinement: APEX2; data reduction: SAINT (Bruker, 2005); program(s) used to solve structure: SHELXTL (Sheldrick, 1998); program(s) used to refine structure: SHELXTL; molecular graphics: SHELXTL; software used to prepare material for publication: SHELXTL, PLATON (Spek, 2003) and PARST (Nardelli, 1995).
[PtCl2(C18H15P)2] | F(000) = 3104 |
Mr = 790.52 | Dx = 1.700 Mg m−3 |
Monoclinic, P21/c | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: -P 2ybc | Cell parameters from 12898 reflections |
a = 32.5958 (4) Å | θ = 0.6–30.0° |
b = 9.6895 (1) Å | µ = 4.85 mm−1 |
c = 19.6170 (2) Å | T = 297 K |
β = 94.476 (1)° | Block, purple |
V = 6176.88 (12) Å3 | 0.30 × 0.29 × 0.06 mm |
Z = 8 |
Bruker SMART APEX2 CCD area-detector diffractometer | 18034 independent reflections |
Radiation source: fine-focus sealed tube | 12898 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.049 |
Detector resolution: 8.33 pixels mm-1 | θmax = 30.0°, θmin = 0.6° |
ω scans | h = −44→45 |
Absorption correction: multi-scan (SADABS; Bruker, 2005) | k = −13→13 |
Tmin = 0.255, Tmax = 0.748 | l = −27→27 |
150461 measured reflections |
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)] = 0.031 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.071 | H-atom parameters constrained |
S = 1.02 | w = 1/[σ2(Fo2) + (0.0197P)2 + 12.2287P] where P = (Fo2 + 2Fc2)/3 |
18034 reflections | (Δ/σ)max = 0.005 |
739 parameters | Δρmax = 1.11 e Å−3 |
0 restraints | Δρmin = −1.15 e Å−3 |
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 | ||
Pt1A | 0.613662 (4) | 0.490933 (13) | 0.299274 (5) | 0.02517 (3) | |
Pt1B | 0.120412 (4) | 0.503993 (15) | 0.452710 (7) | 0.03677 (4) | |
Cl1A | 0.65817 (3) | 0.51346 (10) | 0.21043 (4) | 0.0411 (2) | |
Cl2A | 0.57167 (3) | 0.35423 (12) | 0.22525 (5) | 0.0511 (3) | |
Cl1B | 0.12780 (4) | 0.74509 (11) | 0.45921 (7) | 0.0604 (3) | |
Cl2B | 0.09982 (4) | 0.50994 (11) | 0.56475 (5) | 0.0527 (3) | |
P1A | 0.66321 (3) | 0.61321 (9) | 0.36067 (4) | 0.02897 (18) | |
P2A | 0.56728 (3) | 0.47525 (9) | 0.37817 (4) | 0.02660 (17) | |
P1B | 0.15321 (3) | 0.51771 (10) | 0.35495 (5) | 0.0377 (2) | |
P2B | 0.10318 (3) | 0.27797 (10) | 0.45040 (5) | 0.0399 (2) | |
C1A | 0.51612 (11) | 0.4061 (4) | 0.35084 (16) | 0.0320 (7) | |
C2A | 0.51162 (13) | 0.2646 (4) | 0.34207 (19) | 0.0423 (9) | |
H2AA | 0.5347 | 0.2080 | 0.3467 | 0.051* | |
C3A | 0.47324 (14) | 0.2069 (5) | 0.3265 (2) | 0.0524 (11) | |
H3AA | 0.4707 | 0.1120 | 0.3205 | 0.063* | |
C4A | 0.43887 (14) | 0.2890 (5) | 0.3199 (2) | 0.0541 (12) | |
H4AA | 0.4131 | 0.2498 | 0.3099 | 0.065* | |
C5A | 0.44267 (14) | 0.4275 (6) | 0.3279 (2) | 0.0598 (13) | |
H5AA | 0.4194 | 0.4832 | 0.3231 | 0.072* | |
C6A | 0.48125 (13) | 0.4873 (4) | 0.3434 (2) | 0.0460 (9) | |
H6AA | 0.4835 | 0.5824 | 0.3487 | 0.055* | |
C7A | 0.58246 (11) | 0.3558 (4) | 0.44693 (16) | 0.0305 (7) | |
C8A | 0.61465 (12) | 0.2647 (4) | 0.43952 (18) | 0.0371 (8) | |
H8AA | 0.6289 | 0.2676 | 0.4003 | 0.044* | |
C9A | 0.62558 (14) | 0.1694 (4) | 0.4905 (2) | 0.0463 (10) | |
H9AA | 0.6470 | 0.1081 | 0.4851 | 0.056* | |
C10A | 0.60492 (14) | 0.1650 (4) | 0.5489 (2) | 0.0499 (11) | |
H10A | 0.6132 | 0.1040 | 0.5839 | 0.060* | |
C11A | 0.57195 (14) | 0.2510 (4) | 0.55537 (19) | 0.0496 (11) | |
H11A | 0.5574 | 0.2458 | 0.5942 | 0.059* | |
C12A | 0.56019 (13) | 0.3452 (4) | 0.50465 (18) | 0.0413 (9) | |
H12A | 0.5374 | 0.4016 | 0.5090 | 0.050* | |
C13A | 0.55626 (11) | 0.6456 (4) | 0.41083 (17) | 0.0311 (7) | |
C14A | 0.56023 (12) | 0.6871 (4) | 0.47920 (19) | 0.0410 (9) | |
H14A | 0.5686 | 0.6242 | 0.5133 | 0.049* | |
C15A | 0.55169 (15) | 0.8224 (5) | 0.4958 (2) | 0.0532 (11) | |
H15A | 0.5549 | 0.8503 | 0.5413 | 0.064* | |
C16A | 0.53859 (14) | 0.9160 (5) | 0.4463 (3) | 0.0554 (12) | |
H16A | 0.5327 | 1.0062 | 0.4584 | 0.067* | |
C17A | 0.53426 (14) | 0.8761 (4) | 0.3788 (2) | 0.0494 (10) | |
H17A | 0.5250 | 0.9387 | 0.3451 | 0.059* | |
C18A | 0.54378 (12) | 0.7425 (4) | 0.36141 (19) | 0.0411 (9) | |
H18A | 0.5418 | 0.7169 | 0.3156 | 0.049* | |
C19A | 0.67093 (12) | 0.7811 (4) | 0.32065 (17) | 0.0344 (8) | |
C20A | 0.70654 (14) | 0.8168 (4) | 0.2917 (2) | 0.0464 (10) | |
H20A | 0.7282 | 0.7541 | 0.2920 | 0.056* | |
C21A | 0.71033 (16) | 0.9453 (5) | 0.2622 (2) | 0.0576 (12) | |
H21A | 0.7346 | 0.9683 | 0.2429 | 0.069* | |
C22A | 0.67889 (17) | 1.0392 (5) | 0.2611 (2) | 0.0578 (13) | |
H22A | 0.6816 | 1.1253 | 0.2410 | 0.069* | |
C23A | 0.64358 (16) | 1.0048 (4) | 0.2898 (2) | 0.0554 (11) | |
H23A | 0.6223 | 1.0686 | 0.2898 | 0.066* | |
C24A | 0.63894 (13) | 0.8757 (4) | 0.3191 (2) | 0.0470 (10) | |
H24A | 0.6144 | 0.8528 | 0.3376 | 0.056* | |
C25A | 0.71204 (11) | 0.5190 (4) | 0.36574 (16) | 0.0327 (7) | |
C26A | 0.71401 (12) | 0.3829 (4) | 0.34414 (18) | 0.0385 (8) | |
H26A | 0.6906 | 0.3397 | 0.3241 | 0.046* | |
C27A | 0.75104 (14) | 0.3113 (5) | 0.3526 (2) | 0.0512 (11) | |
H27A | 0.7522 | 0.2199 | 0.3384 | 0.061* | |
C28A | 0.78568 (14) | 0.3740 (5) | 0.3815 (2) | 0.0548 (12) | |
H28A | 0.8104 | 0.3257 | 0.3867 | 0.066* | |
C29A | 0.78394 (12) | 0.5083 (5) | 0.4029 (2) | 0.0495 (10) | |
H29A | 0.8077 | 0.5513 | 0.4219 | 0.059* | |
C30A | 0.74724 (12) | 0.5807 (4) | 0.39647 (19) | 0.0415 (9) | |
H30A | 0.7461 | 0.6706 | 0.4127 | 0.050* | |
C31A | 0.66114 (10) | 0.6542 (4) | 0.45168 (16) | 0.0303 (7) | |
C32A | 0.66084 (14) | 0.7871 (4) | 0.4774 (2) | 0.0497 (11) | |
H32A | 0.6599 | 0.8620 | 0.4477 | 0.060* | |
C33A | 0.66190 (16) | 0.8089 (5) | 0.5473 (2) | 0.0605 (13) | |
H33A | 0.6620 | 0.8987 | 0.5641 | 0.073* | |
C34A | 0.66280 (14) | 0.7008 (5) | 0.5921 (2) | 0.0501 (11) | |
H34A | 0.6626 | 0.7165 | 0.6389 | 0.060* | |
C35A | 0.66398 (14) | 0.5686 (5) | 0.5671 (2) | 0.0482 (10) | |
H35A | 0.6651 | 0.4942 | 0.5971 | 0.058* | |
C36A | 0.66343 (12) | 0.5459 (4) | 0.49756 (18) | 0.0393 (9) | |
H36A | 0.6646 | 0.4560 | 0.4813 | 0.047* | |
C1B | 0.05914 (12) | 0.2362 (4) | 0.4988 (2) | 0.0425 (9) | |
C2B | 0.05810 (14) | 0.1207 (5) | 0.5397 (2) | 0.0533 (11) | |
H2BA | 0.0811 | 0.0639 | 0.5458 | 0.064* | |
C3B | 0.02247 (15) | 0.0891 (5) | 0.5721 (3) | 0.0638 (13) | |
H3BA | 0.0221 | 0.0125 | 0.6006 | 0.077* | |
C4B | −0.01157 (15) | 0.1697 (5) | 0.5620 (3) | 0.0634 (13) | |
H4BA | −0.0351 | 0.1484 | 0.5837 | 0.076* | |
C5B | −0.01115 (15) | 0.2824 (5) | 0.5197 (3) | 0.0630 (13) | |
H5BA | −0.0347 | 0.3363 | 0.5121 | 0.076* | |
C6B | 0.02409 (14) | 0.3163 (5) | 0.4885 (2) | 0.0565 (12) | |
H6BA | 0.0242 | 0.3935 | 0.4603 | 0.068* | |
C7B | 0.14567 (13) | 0.1716 (4) | 0.4866 (2) | 0.0453 (10) | |
C8B | 0.16975 (15) | 0.0909 (5) | 0.4476 (3) | 0.0592 (12) | |
H8BA | 0.1633 | 0.0827 | 0.4008 | 0.071* | |
C9B | 0.20328 (17) | 0.0228 (5) | 0.4781 (3) | 0.0754 (16) | |
H9BA | 0.2192 | −0.0319 | 0.4515 | 0.090* | |
C10B | 0.21379 (17) | 0.0339 (6) | 0.5468 (3) | 0.0754 (16) | |
H10B | 0.2366 | −0.0131 | 0.5667 | 0.090* | |
C11B | 0.19043 (15) | 0.1150 (6) | 0.5864 (3) | 0.0657 (14) | |
H11B | 0.1976 | 0.1241 | 0.6330 | 0.079* | |
C12B | 0.15613 (14) | 0.1833 (5) | 0.5566 (2) | 0.0550 (11) | |
H12B | 0.1401 | 0.2370 | 0.5834 | 0.066* | |
C13B | 0.08413 (14) | 0.2143 (5) | 0.3664 (2) | 0.0491 (10) | |
C14B | 0.06385 (14) | 0.3073 (6) | 0.3226 (2) | 0.0590 (12) | |
H14B | 0.0606 | 0.3979 | 0.3368 | 0.071* | |
C15B | 0.04821 (18) | 0.2684 (8) | 0.2576 (3) | 0.0868 (19) | |
H15B | 0.0345 | 0.3326 | 0.2288 | 0.104* | |
C16B | 0.0529 (2) | 0.1360 (10) | 0.2361 (4) | 0.113 (3) | |
H16B | 0.0435 | 0.1099 | 0.1920 | 0.136* | |
C17B | 0.0719 (3) | 0.0414 (8) | 0.2807 (4) | 0.113 (3) | |
H17B | 0.0747 | −0.0493 | 0.2663 | 0.135* | |
C18B | 0.08667 (19) | 0.0780 (6) | 0.3461 (3) | 0.0788 (17) | |
H18B | 0.0982 | 0.0118 | 0.3761 | 0.095* | |
C19B | 0.12408 (13) | 0.5896 (4) | 0.2806 (2) | 0.0456 (10) | |
C20B | 0.13866 (16) | 0.5879 (5) | 0.2165 (2) | 0.0575 (12) | |
H20B | 0.1643 | 0.5491 | 0.2110 | 0.069* | |
C21B | 0.1161 (2) | 0.6425 (6) | 0.1599 (3) | 0.0782 (18) | |
H21B | 0.1269 | 0.6431 | 0.1174 | 0.094* | |
C22B | 0.0780 (2) | 0.6952 (6) | 0.1671 (4) | 0.091 (2) | |
H22B | 0.0628 | 0.7316 | 0.1293 | 0.109* | |
C23B | 0.06196 (18) | 0.6950 (6) | 0.2298 (4) | 0.0830 (19) | |
H23B | 0.0355 | 0.7279 | 0.2339 | 0.100* | |
C24B | 0.08538 (15) | 0.6454 (5) | 0.2876 (3) | 0.0636 (13) | |
H24B | 0.0751 | 0.6498 | 0.3304 | 0.076* | |
C25B | 0.19929 (12) | 0.6259 (4) | 0.37062 (19) | 0.0377 (8) | |
C26B | 0.22094 (13) | 0.6197 (5) | 0.4337 (2) | 0.0512 (11) | |
H26B | 0.2107 | 0.5672 | 0.4683 | 0.061* | |
C27B | 0.25775 (14) | 0.6905 (5) | 0.4465 (2) | 0.0558 (12) | |
H27B | 0.2720 | 0.6851 | 0.4894 | 0.067* | |
C28B | 0.27308 (13) | 0.7685 (5) | 0.3959 (2) | 0.0515 (11) | |
H28B | 0.2981 | 0.8142 | 0.4041 | 0.062* | |
C29B | 0.25156 (14) | 0.7789 (5) | 0.3336 (2) | 0.0516 (11) | |
H29B | 0.2618 | 0.8329 | 0.2996 | 0.062* | |
C30B | 0.21454 (13) | 0.7096 (4) | 0.3204 (2) | 0.0442 (9) | |
H30B | 0.1999 | 0.7188 | 0.2781 | 0.053* | |
C31B | 0.17618 (13) | 0.3599 (4) | 0.3222 (2) | 0.0418 (9) | |
C32B | 0.21348 (14) | 0.3110 (5) | 0.3522 (2) | 0.0540 (11) | |
H32B | 0.2270 | 0.3587 | 0.3885 | 0.065* | |
C33B | 0.23053 (17) | 0.1902 (5) | 0.3278 (3) | 0.0648 (14) | |
H33B | 0.2556 | 0.1582 | 0.3475 | 0.078* | |
C34B | 0.21048 (18) | 0.1187 (5) | 0.2750 (3) | 0.0664 (14) | |
H34B | 0.2221 | 0.0384 | 0.2591 | 0.080* | |
C35B | 0.17367 (17) | 0.1640 (5) | 0.2456 (3) | 0.0624 (13) | |
H35B | 0.1602 | 0.1142 | 0.2100 | 0.075* | |
C36B | 0.15628 (15) | 0.2845 (5) | 0.2686 (2) | 0.0525 (11) | |
H36B | 0.1312 | 0.3152 | 0.2482 | 0.063* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Pt1A | 0.02875 (7) | 0.02752 (6) | 0.01936 (5) | 0.00182 (6) | 0.00256 (4) | −0.00071 (5) |
Pt1B | 0.03297 (8) | 0.03188 (8) | 0.04640 (8) | −0.00062 (6) | 0.00914 (6) | −0.00109 (6) |
Cl1A | 0.0435 (5) | 0.0540 (6) | 0.0271 (4) | −0.0028 (5) | 0.0117 (3) | −0.0008 (4) |
Cl2A | 0.0512 (6) | 0.0673 (7) | 0.0352 (5) | −0.0169 (5) | 0.0060 (4) | −0.0206 (5) |
Cl1B | 0.0599 (7) | 0.0327 (5) | 0.0913 (9) | −0.0041 (5) | 0.0236 (6) | −0.0066 (5) |
Cl2B | 0.0555 (6) | 0.0542 (6) | 0.0504 (5) | −0.0003 (5) | 0.0164 (5) | −0.0084 (5) |
P1A | 0.0293 (5) | 0.0306 (4) | 0.0271 (4) | 0.0011 (4) | 0.0028 (3) | −0.0031 (3) |
P2A | 0.0274 (4) | 0.0293 (4) | 0.0233 (4) | 0.0023 (3) | 0.0031 (3) | 0.0007 (3) |
P1B | 0.0343 (5) | 0.0360 (5) | 0.0434 (5) | 0.0011 (4) | 0.0066 (4) | 0.0044 (4) |
P2B | 0.0387 (6) | 0.0332 (5) | 0.0490 (6) | −0.0016 (4) | 0.0103 (5) | 0.0008 (4) |
C1A | 0.033 (2) | 0.0375 (19) | 0.0261 (16) | 0.0010 (15) | 0.0061 (14) | 0.0001 (14) |
C2A | 0.041 (2) | 0.040 (2) | 0.046 (2) | −0.0030 (18) | −0.0010 (18) | 0.0050 (17) |
C3A | 0.058 (3) | 0.053 (3) | 0.046 (2) | −0.021 (2) | 0.000 (2) | 0.0011 (19) |
C4A | 0.035 (2) | 0.084 (4) | 0.043 (2) | −0.013 (2) | 0.0001 (18) | −0.011 (2) |
C5A | 0.038 (3) | 0.075 (3) | 0.065 (3) | 0.007 (2) | −0.004 (2) | −0.021 (3) |
C6A | 0.040 (2) | 0.049 (2) | 0.048 (2) | 0.006 (2) | −0.0003 (17) | −0.0117 (19) |
C7A | 0.0319 (19) | 0.0314 (18) | 0.0282 (16) | −0.0007 (15) | 0.0020 (14) | 0.0032 (13) |
C8A | 0.044 (2) | 0.0324 (19) | 0.0357 (18) | 0.0058 (17) | 0.0060 (16) | 0.0016 (15) |
C9A | 0.051 (3) | 0.038 (2) | 0.049 (2) | 0.0114 (19) | −0.0006 (19) | 0.0040 (17) |
C10A | 0.067 (3) | 0.045 (2) | 0.037 (2) | 0.008 (2) | 0.000 (2) | 0.0152 (17) |
C11A | 0.065 (3) | 0.053 (3) | 0.0328 (19) | 0.005 (2) | 0.0127 (19) | 0.0097 (18) |
C12A | 0.044 (2) | 0.045 (2) | 0.0355 (19) | 0.0074 (18) | 0.0099 (17) | 0.0079 (16) |
C13A | 0.0296 (19) | 0.0324 (18) | 0.0320 (17) | 0.0025 (15) | 0.0066 (14) | −0.0023 (14) |
C14A | 0.042 (2) | 0.045 (2) | 0.037 (2) | 0.0061 (18) | 0.0039 (17) | −0.0026 (16) |
C15A | 0.065 (3) | 0.051 (3) | 0.044 (2) | 0.005 (2) | 0.013 (2) | −0.017 (2) |
C16A | 0.054 (3) | 0.038 (2) | 0.076 (3) | 0.004 (2) | 0.022 (2) | −0.013 (2) |
C17A | 0.051 (3) | 0.036 (2) | 0.062 (3) | 0.0100 (19) | 0.012 (2) | 0.0075 (19) |
C18A | 0.047 (2) | 0.039 (2) | 0.0379 (19) | 0.0051 (18) | 0.0076 (17) | 0.0012 (16) |
C19A | 0.039 (2) | 0.0325 (18) | 0.0311 (17) | −0.0015 (16) | −0.0009 (15) | −0.0006 (14) |
C20A | 0.050 (3) | 0.043 (2) | 0.048 (2) | −0.0013 (19) | 0.0129 (19) | 0.0008 (18) |
C21A | 0.065 (3) | 0.054 (3) | 0.056 (3) | −0.018 (2) | 0.018 (2) | 0.005 (2) |
C22A | 0.086 (4) | 0.037 (2) | 0.050 (2) | −0.016 (2) | 0.002 (2) | 0.0056 (19) |
C23A | 0.066 (3) | 0.038 (2) | 0.060 (3) | 0.007 (2) | −0.010 (2) | 0.002 (2) |
C24A | 0.041 (2) | 0.045 (2) | 0.054 (2) | 0.0013 (19) | −0.0003 (19) | 0.0080 (19) |
C25A | 0.0283 (18) | 0.042 (2) | 0.0288 (15) | 0.0038 (16) | 0.0045 (13) | 0.0019 (14) |
C26A | 0.039 (2) | 0.041 (2) | 0.0351 (18) | 0.0056 (17) | 0.0025 (16) | 0.0019 (15) |
C27A | 0.058 (3) | 0.049 (3) | 0.047 (2) | 0.020 (2) | 0.005 (2) | −0.0001 (19) |
C28A | 0.042 (3) | 0.072 (3) | 0.051 (2) | 0.022 (2) | 0.004 (2) | 0.008 (2) |
C29A | 0.031 (2) | 0.075 (3) | 0.042 (2) | −0.001 (2) | 0.0001 (16) | 0.006 (2) |
C30A | 0.036 (2) | 0.047 (2) | 0.041 (2) | −0.0008 (18) | 0.0030 (17) | −0.0017 (17) |
C31A | 0.0244 (18) | 0.0378 (19) | 0.0286 (16) | 0.0024 (15) | 0.0008 (13) | −0.0061 (14) |
C32A | 0.074 (3) | 0.039 (2) | 0.035 (2) | 0.008 (2) | 0.002 (2) | −0.0059 (17) |
C33A | 0.089 (4) | 0.048 (3) | 0.043 (2) | 0.014 (3) | 0.000 (2) | −0.017 (2) |
C34A | 0.056 (3) | 0.063 (3) | 0.0313 (19) | 0.009 (2) | −0.0004 (18) | −0.0122 (19) |
C35A | 0.054 (3) | 0.056 (3) | 0.0335 (19) | 0.002 (2) | 0.0014 (18) | 0.0035 (18) |
C36A | 0.044 (2) | 0.039 (2) | 0.0347 (18) | −0.0006 (17) | 0.0009 (16) | −0.0036 (15) |
C1B | 0.034 (2) | 0.040 (2) | 0.054 (2) | −0.0016 (17) | 0.0083 (18) | −0.0010 (18) |
C2B | 0.043 (3) | 0.048 (3) | 0.071 (3) | 0.002 (2) | 0.014 (2) | 0.015 (2) |
C3B | 0.053 (3) | 0.067 (3) | 0.074 (3) | −0.005 (3) | 0.018 (2) | 0.022 (3) |
C4B | 0.045 (3) | 0.070 (3) | 0.077 (3) | −0.008 (3) | 0.022 (2) | 0.004 (3) |
C5B | 0.041 (3) | 0.063 (3) | 0.086 (4) | 0.008 (2) | 0.010 (2) | 0.004 (3) |
C6B | 0.049 (3) | 0.049 (3) | 0.073 (3) | 0.003 (2) | 0.014 (2) | 0.012 (2) |
C7B | 0.042 (2) | 0.032 (2) | 0.063 (3) | −0.0007 (17) | 0.014 (2) | 0.0053 (18) |
C8B | 0.064 (3) | 0.046 (3) | 0.070 (3) | 0.011 (2) | 0.025 (3) | 0.005 (2) |
C9B | 0.065 (4) | 0.062 (3) | 0.103 (5) | 0.025 (3) | 0.031 (3) | 0.018 (3) |
C10B | 0.057 (3) | 0.061 (3) | 0.108 (5) | 0.015 (3) | 0.010 (3) | 0.032 (3) |
C11B | 0.046 (3) | 0.071 (3) | 0.079 (3) | −0.003 (3) | 0.000 (3) | 0.011 (3) |
C12B | 0.042 (3) | 0.055 (3) | 0.069 (3) | 0.000 (2) | 0.007 (2) | 0.000 (2) |
C13B | 0.051 (3) | 0.046 (2) | 0.051 (2) | −0.018 (2) | 0.013 (2) | −0.0063 (19) |
C14B | 0.048 (3) | 0.071 (3) | 0.057 (3) | −0.015 (2) | 0.004 (2) | 0.001 (2) |
C15B | 0.070 (4) | 0.123 (6) | 0.064 (3) | −0.027 (4) | −0.010 (3) | 0.001 (4) |
C16B | 0.108 (6) | 0.154 (8) | 0.078 (5) | −0.049 (6) | 0.008 (4) | −0.045 (5) |
C17B | 0.130 (7) | 0.095 (5) | 0.116 (6) | −0.042 (5) | 0.021 (5) | −0.060 (5) |
C18B | 0.093 (4) | 0.051 (3) | 0.095 (4) | −0.019 (3) | 0.021 (3) | −0.026 (3) |
C19B | 0.043 (2) | 0.035 (2) | 0.057 (2) | −0.0051 (18) | −0.0073 (19) | 0.0066 (18) |
C20B | 0.064 (3) | 0.055 (3) | 0.051 (3) | −0.014 (2) | −0.009 (2) | 0.008 (2) |
C21B | 0.104 (5) | 0.067 (4) | 0.058 (3) | −0.033 (3) | −0.028 (3) | 0.018 (3) |
C22B | 0.099 (5) | 0.059 (4) | 0.105 (5) | −0.020 (3) | −0.053 (4) | 0.025 (3) |
C23B | 0.060 (4) | 0.058 (3) | 0.126 (6) | 0.004 (3) | −0.028 (4) | 0.015 (3) |
C24B | 0.050 (3) | 0.048 (3) | 0.091 (4) | 0.000 (2) | −0.003 (3) | 0.007 (3) |
C25B | 0.033 (2) | 0.038 (2) | 0.042 (2) | −0.0005 (16) | 0.0066 (16) | 0.0007 (16) |
C26B | 0.043 (3) | 0.066 (3) | 0.045 (2) | −0.001 (2) | 0.0035 (19) | 0.010 (2) |
C27B | 0.043 (3) | 0.072 (3) | 0.051 (3) | 0.005 (2) | −0.006 (2) | −0.003 (2) |
C28B | 0.033 (2) | 0.053 (3) | 0.069 (3) | −0.005 (2) | 0.006 (2) | −0.008 (2) |
C29B | 0.050 (3) | 0.049 (3) | 0.058 (3) | −0.008 (2) | 0.013 (2) | 0.003 (2) |
C30B | 0.044 (2) | 0.046 (2) | 0.043 (2) | −0.0051 (19) | 0.0038 (18) | 0.0052 (17) |
C31B | 0.040 (2) | 0.039 (2) | 0.048 (2) | 0.0032 (18) | 0.0162 (18) | 0.0080 (17) |
C32B | 0.050 (3) | 0.054 (3) | 0.059 (3) | 0.009 (2) | 0.011 (2) | 0.011 (2) |
C33B | 0.062 (3) | 0.060 (3) | 0.075 (3) | 0.020 (3) | 0.021 (3) | 0.016 (3) |
C34B | 0.083 (4) | 0.050 (3) | 0.072 (3) | 0.017 (3) | 0.035 (3) | 0.007 (2) |
C35B | 0.078 (4) | 0.052 (3) | 0.059 (3) | −0.001 (3) | 0.023 (3) | −0.008 (2) |
C36B | 0.060 (3) | 0.048 (2) | 0.052 (2) | 0.002 (2) | 0.018 (2) | −0.001 (2) |
Pt1A—P2A | 2.2515 (8) | C31A—C32A | 1.383 (5) |
Pt1A—P1A | 2.2713 (9) | C32A—C33A | 1.386 (5) |
Pt1A—Cl2A | 2.3294 (9) | C32A—H32A | 0.9300 |
Pt1A—Cl1A | 2.3632 (8) | C33A—C34A | 1.366 (6) |
Pt1B—P2B | 2.2605 (10) | C33A—H33A | 0.9300 |
Pt1B—P1B | 2.2713 (10) | C34A—C35A | 1.373 (6) |
Pt1B—Cl2B | 2.3483 (10) | C34A—H34A | 0.9300 |
Pt1B—Cl1B | 2.3509 (11) | C35A—C36A | 1.380 (5) |
P1A—C25A | 1.831 (4) | C35A—H35A | 0.9300 |
P1A—C19A | 1.832 (4) | C36A—H36A | 0.9300 |
P1A—C31A | 1.835 (3) | C1B—C2B | 1.379 (6) |
P2A—C7A | 1.817 (3) | C1B—C6B | 1.383 (6) |
P2A—C13A | 1.817 (3) | C2B—C3B | 1.401 (6) |
P2A—C1A | 1.838 (4) | C2B—H2BA | 0.9300 |
P1B—C19B | 1.816 (4) | C3B—C4B | 1.359 (7) |
P1B—C25B | 1.838 (4) | C3B—H3BA | 0.9300 |
P1B—C31B | 1.840 (4) | C4B—C5B | 1.372 (7) |
P2B—C13B | 1.822 (4) | C4B—H4BA | 0.9300 |
P2B—C7B | 1.825 (4) | C5B—C6B | 1.383 (6) |
P2B—C1B | 1.827 (4) | C5B—H5BA | 0.9300 |
C1A—C6A | 1.381 (5) | C6B—H6BA | 0.9300 |
C1A—C2A | 1.388 (5) | C7B—C8B | 1.380 (6) |
C2A—C3A | 1.383 (6) | C7B—C12B | 1.393 (6) |
C2A—H2AA | 0.9300 | C8B—C9B | 1.373 (7) |
C3A—C4A | 1.372 (6) | C8B—H8BA | 0.9300 |
C3A—H3AA | 0.9300 | C9B—C10B | 1.369 (8) |
C4A—C5A | 1.356 (7) | C9B—H9BA | 0.9300 |
C4A—H4AA | 0.9300 | C10B—C11B | 1.375 (7) |
C5A—C6A | 1.396 (6) | C10B—H10B | 0.9300 |
C5A—H5AA | 0.9300 | C11B—C12B | 1.388 (6) |
C6A—H6AA | 0.9300 | C11B—H11B | 0.9300 |
C7A—C8A | 1.387 (5) | C12B—H12B | 0.9300 |
C7A—C12A | 1.396 (5) | C13B—C14B | 1.378 (6) |
C8A—C9A | 1.387 (5) | C13B—C18B | 1.384 (6) |
C8A—H8AA | 0.9300 | C14B—C15B | 1.387 (7) |
C9A—C10A | 1.374 (6) | C14B—H14B | 0.9300 |
C9A—H9AA | 0.9300 | C15B—C16B | 1.363 (10) |
C10A—C11A | 1.374 (6) | C15B—H15B | 0.9300 |
C10A—H10A | 0.9300 | C16B—C17B | 1.379 (11) |
C11A—C12A | 1.382 (5) | C16B—H16B | 0.9300 |
C11A—H11A | 0.9300 | C17B—C18B | 1.382 (9) |
C12A—H12A | 0.9300 | C17B—H17B | 0.9300 |
C13A—C18A | 1.388 (5) | C18B—H18B | 0.9300 |
C13A—C14A | 1.396 (5) | C19B—C20B | 1.379 (6) |
C14A—C15A | 1.384 (5) | C19B—C24B | 1.389 (6) |
C14A—H14A | 0.9300 | C20B—C21B | 1.388 (6) |
C15A—C16A | 1.372 (6) | C20B—H20B | 0.9300 |
C15A—H15A | 0.9300 | C21B—C22B | 1.358 (9) |
C16A—C17A | 1.377 (6) | C21B—H21B | 0.9300 |
C16A—H16A | 0.9300 | C22B—C23B | 1.374 (9) |
C17A—C18A | 1.379 (5) | C22B—H22B | 0.9300 |
C17A—H17A | 0.9300 | C23B—C24B | 1.401 (7) |
C18A—H18A | 0.9300 | C23B—H23B | 0.9300 |
C19A—C20A | 1.375 (5) | C24B—H24B | 0.9300 |
C19A—C24A | 1.387 (5) | C25B—C26B | 1.378 (5) |
C20A—C21A | 1.383 (6) | C25B—C30B | 1.396 (5) |
C20A—H20A | 0.9300 | C26B—C27B | 1.388 (6) |
C21A—C22A | 1.369 (7) | C26B—H26B | 0.9300 |
C21A—H21A | 0.9300 | C27B—C28B | 1.372 (6) |
C22A—C23A | 1.362 (7) | C27B—H27B | 0.9300 |
C22A—H22A | 0.9300 | C28B—C29B | 1.366 (6) |
C23A—C24A | 1.389 (6) | C28B—H28B | 0.9300 |
C23A—H23A | 0.9300 | C29B—C30B | 1.387 (6) |
C24A—H24A | 0.9300 | C29B—H29B | 0.9300 |
C25A—C26A | 1.388 (5) | C30B—H30B | 0.9300 |
C25A—C30A | 1.389 (5) | C31B—C32B | 1.392 (6) |
C26A—C27A | 1.391 (5) | C31B—C36B | 1.398 (6) |
C26A—H26A | 0.9300 | C32B—C33B | 1.396 (6) |
C27A—C28A | 1.366 (6) | C32B—H32B | 0.9300 |
C27A—H27A | 0.9300 | C33B—C34B | 1.368 (7) |
C28A—C29A | 1.370 (6) | C33B—H33B | 0.9300 |
C28A—H28A | 0.9300 | C34B—C35B | 1.363 (7) |
C29A—C30A | 1.384 (6) | C34B—H34B | 0.9300 |
C29A—H29A | 0.9300 | C35B—C36B | 1.388 (6) |
C30A—H30A | 0.9300 | C35B—H35B | 0.9300 |
C31A—C36A | 1.380 (5) | C36B—H36B | 0.9300 |
P2A—Pt1A—P1A | 99.12 (3) | C36A—C31A—C32A | 118.1 (3) |
P2A—Pt1A—Cl2A | 89.82 (3) | C36A—C31A—P1A | 117.8 (3) |
P1A—Pt1A—Cl2A | 170.41 (3) | C32A—C31A—P1A | 123.9 (3) |
P2A—Pt1A—Cl1A | 175.57 (3) | C31A—C32A—C33A | 120.2 (4) |
P1A—Pt1A—Cl1A | 83.73 (3) | C31A—C32A—H32A | 119.9 |
Cl2A—Pt1A—Cl1A | 87.56 (3) | C33A—C32A—H32A | 119.9 |
P2B—Pt1B—P1B | 99.93 (4) | C34A—C33A—C32A | 121.2 (4) |
P2B—Pt1B—Cl2B | 87.35 (4) | C34A—C33A—H33A | 119.4 |
P1B—Pt1B—Cl2B | 167.58 (4) | C32A—C33A—H33A | 119.4 |
P2B—Pt1B—Cl1B | 171.13 (4) | C33A—C34A—C35A | 119.0 (4) |
P1B—Pt1B—Cl1B | 86.25 (4) | C33A—C34A—H34A | 120.5 |
Cl2B—Pt1B—Cl1B | 87.73 (4) | C35A—C34A—H34A | 120.5 |
C25A—P1A—C19A | 108.55 (17) | C34A—C35A—C36A | 120.2 (4) |
C25A—P1A—C31A | 98.78 (15) | C34A—C35A—H35A | 119.9 |
C19A—P1A—C31A | 103.97 (16) | C36A—C35A—H35A | 119.9 |
C25A—P1A—Pt1A | 110.36 (12) | C35A—C36A—C31A | 121.3 (4) |
C19A—P1A—Pt1A | 110.60 (12) | C35A—C36A—H36A | 119.4 |
C31A—P1A—Pt1A | 123.37 (12) | C31A—C36A—H36A | 119.4 |
C7A—P2A—C13A | 111.55 (16) | C2B—C1B—C6B | 118.9 (4) |
C7A—P2A—C1A | 99.94 (16) | C2B—C1B—P2B | 122.6 (3) |
C13A—P2A—C1A | 103.55 (16) | C6B—C1B—P2B | 118.2 (3) |
C7A—P2A—Pt1A | 113.25 (12) | C1B—C2B—C3B | 120.0 (4) |
C13A—P2A—Pt1A | 110.06 (11) | C1B—C2B—H2BA | 120.0 |
C1A—P2A—Pt1A | 117.81 (11) | C3B—C2B—H2BA | 120.0 |
C19B—P1B—C25B | 106.55 (18) | C4B—C3B—C2B | 120.3 (5) |
C19B—P1B—C31B | 103.88 (19) | C4B—C3B—H3BA | 119.8 |
C25B—P1B—C31B | 100.55 (18) | C2B—C3B—H3BA | 119.8 |
C19B—P1B—Pt1B | 116.72 (15) | C3B—C4B—C5B | 119.9 (4) |
C25B—P1B—Pt1B | 108.94 (12) | C3B—C4B—H4BA | 120.0 |
C31B—P1B—Pt1B | 118.49 (12) | C5B—C4B—H4BA | 120.0 |
C13B—P2B—C7B | 110.8 (2) | C4B—C5B—C6B | 120.3 (5) |
C13B—P2B—C1B | 99.71 (19) | C4B—C5B—H5BA | 119.8 |
C7B—P2B—C1B | 106.01 (19) | C6B—C5B—H5BA | 119.8 |
C13B—P2B—Pt1B | 114.37 (15) | C5B—C6B—C1B | 120.5 (4) |
C7B—P2B—Pt1B | 111.06 (14) | C5B—C6B—H6BA | 119.8 |
C1B—P2B—Pt1B | 114.10 (14) | C1B—C6B—H6BA | 119.8 |
C6A—C1A—C2A | 118.1 (4) | C8B—C7B—C12B | 119.1 (4) |
C6A—C1A—P2A | 122.9 (3) | C8B—C7B—P2B | 123.5 (4) |
C2A—C1A—P2A | 118.8 (3) | C12B—C7B—P2B | 117.2 (3) |
C3A—C2A—C1A | 120.8 (4) | C9B—C8B—C7B | 119.9 (5) |
C3A—C2A—H2AA | 119.6 | C9B—C8B—H8BA | 120.0 |
C1A—C2A—H2AA | 119.6 | C7B—C8B—H8BA | 120.0 |
C4A—C3A—C2A | 120.3 (4) | C10B—C9B—C8B | 121.4 (5) |
C4A—C3A—H3AA | 119.8 | C10B—C9B—H9BA | 119.3 |
C2A—C3A—H3AA | 119.8 | C8B—C9B—H9BA | 119.3 |
C5A—C4A—C3A | 119.8 (4) | C9B—C10B—C11B | 119.5 (5) |
C5A—C4A—H4AA | 120.1 | C9B—C10B—H10B | 120.2 |
C3A—C4A—H4AA | 120.1 | C11B—C10B—H10B | 120.2 |
C4A—C5A—C6A | 120.6 (4) | C10B—C11B—C12B | 119.9 (5) |
C4A—C5A—H5AA | 119.7 | C10B—C11B—H11B | 120.1 |
C6A—C5A—H5AA | 119.7 | C12B—C11B—H11B | 120.1 |
C1A—C6A—C5A | 120.4 (4) | C11B—C12B—C7B | 120.2 (5) |
C1A—C6A—H6AA | 119.8 | C11B—C12B—H12B | 119.9 |
C5A—C6A—H6AA | 119.8 | C7B—C12B—H12B | 119.9 |
C8A—C7A—C12A | 119.0 (3) | C14B—C13B—C18B | 118.7 (5) |
C8A—C7A—P2A | 119.5 (3) | C14B—C13B—P2B | 117.1 (3) |
C12A—C7A—P2A | 121.3 (3) | C18B—C13B—P2B | 124.0 (4) |
C7A—C8A—C9A | 120.1 (3) | C13B—C14B—C15B | 121.3 (5) |
C7A—C8A—H8AA | 119.9 | C13B—C14B—H14B | 119.4 |
C9A—C8A—H8AA | 119.9 | C15B—C14B—H14B | 119.4 |
C10A—C9A—C8A | 120.4 (4) | C16B—C15B—C14B | 119.9 (7) |
C10A—C9A—H9AA | 119.8 | C16B—C15B—H15B | 120.1 |
C8A—C9A—H9AA | 119.8 | C14B—C15B—H15B | 120.1 |
C11A—C10A—C9A | 119.8 (4) | C15B—C16B—C17B | 119.0 (7) |
C11A—C10A—H10A | 120.1 | C15B—C16B—H16B | 120.5 |
C9A—C10A—H10A | 120.1 | C17B—C16B—H16B | 120.5 |
C10A—C11A—C12A | 120.6 (4) | C16B—C17B—C18B | 121.7 (7) |
C10A—C11A—H11A | 119.7 | C16B—C17B—H17B | 119.2 |
C12A—C11A—H11A | 119.7 | C18B—C17B—H17B | 119.2 |
C11A—C12A—C7A | 120.0 (4) | C17B—C18B—C13B | 119.2 (7) |
C11A—C12A—H12A | 120.0 | C17B—C18B—H18B | 120.4 |
C7A—C12A—H12A | 120.0 | C13B—C18B—H18B | 120.4 |
C18A—C13A—C14A | 118.5 (3) | C20B—C19B—C24B | 118.3 (4) |
C18A—C13A—P2A | 115.1 (3) | C20B—C19B—P1B | 122.2 (4) |
C14A—C13A—P2A | 126.4 (3) | C24B—C19B—P1B | 119.5 (4) |
C15A—C14A—C13A | 119.6 (4) | C19B—C20B—C21B | 121.8 (5) |
C15A—C14A—H14A | 120.2 | C19B—C20B—H20B | 119.1 |
C13A—C14A—H14A | 120.2 | C21B—C20B—H20B | 119.1 |
C16A—C15A—C14A | 121.1 (4) | C22B—C21B—C20B | 119.4 (6) |
C16A—C15A—H15A | 119.5 | C22B—C21B—H21B | 120.3 |
C14A—C15A—H15A | 119.5 | C20B—C21B—H21B | 120.3 |
C15A—C16A—C17A | 119.9 (4) | C21B—C22B—C23B | 120.5 (5) |
C15A—C16A—H16A | 120.1 | C21B—C22B—H22B | 119.7 |
C17A—C16A—H16A | 120.1 | C23B—C22B—H22B | 119.7 |
C16A—C17A—C18A | 119.6 (4) | C22B—C23B—C24B | 120.2 (6) |
C16A—C17A—H17A | 120.2 | C22B—C23B—H23B | 119.9 |
C18A—C17A—H17A | 120.2 | C24B—C23B—H23B | 119.9 |
C17A—C18A—C13A | 121.4 (4) | C19B—C24B—C23B | 119.7 (5) |
C17A—C18A—H18A | 119.3 | C19B—C24B—H24B | 120.1 |
C13A—C18A—H18A | 119.3 | C23B—C24B—H24B | 120.1 |
C20A—C19A—C24A | 118.8 (4) | C26B—C25B—C30B | 118.3 (4) |
C20A—C19A—P1A | 123.2 (3) | C26B—C25B—P1B | 118.7 (3) |
C24A—C19A—P1A | 117.9 (3) | C30B—C25B—P1B | 123.0 (3) |
C19A—C20A—C21A | 120.3 (4) | C25B—C26B—C27B | 121.0 (4) |
C19A—C20A—H20A | 119.8 | C25B—C26B—H26B | 119.5 |
C21A—C20A—H20A | 119.8 | C27B—C26B—H26B | 119.5 |
C22A—C21A—C20A | 120.9 (4) | C28B—C27B—C26B | 120.0 (4) |
C22A—C21A—H21A | 119.5 | C28B—C27B—H27B | 120.0 |
C20A—C21A—H21A | 119.5 | C26B—C27B—H27B | 120.0 |
C23A—C22A—C21A | 119.1 (4) | C29B—C28B—C27B | 119.8 (4) |
C23A—C22A—H22A | 120.5 | C29B—C28B—H28B | 120.1 |
C21A—C22A—H22A | 120.5 | C27B—C28B—H28B | 120.1 |
C22A—C23A—C24A | 120.9 (4) | C28B—C29B—C30B | 120.6 (4) |
C22A—C23A—H23A | 119.5 | C28B—C29B—H29B | 119.7 |
C24A—C23A—H23A | 119.5 | C30B—C29B—H29B | 119.7 |
C19A—C24A—C23A | 119.9 (4) | C29B—C30B—C25B | 120.1 (4) |
C19A—C24A—H24A | 120.1 | C29B—C30B—H30B | 119.9 |
C23A—C24A—H24A | 120.1 | C25B—C30B—H30B | 119.9 |
C26A—C25A—C30A | 119.0 (3) | C32B—C31B—C36B | 118.6 (4) |
C26A—C25A—P1A | 121.2 (3) | C32B—C31B—P1B | 120.1 (3) |
C30A—C25A—P1A | 119.6 (3) | C36B—C31B—P1B | 121.3 (3) |
C25A—C26A—C27A | 119.8 (4) | C31B—C32B—C33B | 119.9 (5) |
C25A—C26A—H26A | 120.1 | C31B—C32B—H32B | 120.1 |
C27A—C26A—H26A | 120.1 | C33B—C32B—H32B | 120.1 |
C28A—C27A—C26A | 120.6 (4) | C34B—C33B—C32B | 120.3 (5) |
C28A—C27A—H27A | 119.7 | C34B—C33B—H33B | 119.8 |
C26A—C27A—H27A | 119.7 | C32B—C33B—H33B | 119.8 |
C27A—C28A—C29A | 119.8 (4) | C35B—C34B—C33B | 120.7 (5) |
C27A—C28A—H28A | 120.1 | C35B—C34B—H34B | 119.7 |
C29A—C28A—H28A | 120.1 | C33B—C34B—H34B | 119.7 |
C28A—C29A—C30A | 120.6 (4) | C34B—C35B—C36B | 120.1 (5) |
C28A—C29A—H29A | 119.7 | C34B—C35B—H35B | 120.0 |
C30A—C29A—H29A | 119.7 | C36B—C35B—H35B | 120.0 |
C29A—C30A—C25A | 120.0 (4) | C35B—C36B—C31B | 120.5 (5) |
C29A—C30A—H30A | 120.0 | C35B—C36B—H36B | 119.8 |
C25A—C30A—H30A | 120.0 | C31B—C36B—H36B | 119.8 |
P2A—Pt1A—P1A—C25A | 122.79 (12) | C19A—P1A—C31A—C36A | −167.8 (3) |
Cl1A—Pt1A—P1A—C25A | −60.63 (12) | Pt1A—P1A—C31A—C36A | 65.5 (3) |
P2A—Pt1A—P1A—C19A | −117.08 (13) | C25A—P1A—C31A—C32A | 118.4 (4) |
Cl1A—Pt1A—P1A—C19A | 59.50 (13) | C19A—P1A—C31A—C32A | 6.7 (4) |
P2A—Pt1A—P1A—C31A | 6.73 (14) | Pt1A—P1A—C31A—C32A | −120.0 (3) |
Cl1A—Pt1A—P1A—C31A | −176.69 (14) | C36A—C31A—C32A—C33A | −1.4 (6) |
P1A—Pt1A—P2A—C7A | −73.02 (13) | P1A—C31A—C32A—C33A | −175.9 (4) |
Cl2A—Pt1A—P2A—C7A | 103.49 (13) | C31A—C32A—C33A—C34A | −0.7 (8) |
P1A—Pt1A—P2A—C13A | 52.61 (13) | C32A—C33A—C34A—C35A | 2.1 (8) |
Cl2A—Pt1A—P2A—C13A | −130.88 (13) | C33A—C34A—C35A—C36A | −1.3 (7) |
P1A—Pt1A—P2A—C1A | 170.94 (13) | C34A—C35A—C36A—C31A | −0.9 (7) |
Cl2A—Pt1A—P2A—C1A | −12.55 (14) | C32A—C31A—C36A—C35A | 2.2 (6) |
P2B—Pt1B—P1B—C19B | 100.76 (15) | P1A—C31A—C36A—C35A | 177.0 (3) |
Cl2B—Pt1B—P1B—C19B | −134.0 (2) | C13B—P2B—C1B—C2B | 99.6 (4) |
Cl1B—Pt1B—P1B—C19B | −72.83 (15) | C7B—P2B—C1B—C2B | −15.5 (4) |
P2B—Pt1B—P1B—C25B | −138.59 (13) | Pt1B—P2B—C1B—C2B | −138.0 (3) |
Cl2B—Pt1B—P1B—C25B | −13.4 (2) | C13B—P2B—C1B—C6B | −73.9 (4) |
Cl1B—Pt1B—P1B—C25B | 47.82 (14) | C7B—P2B—C1B—C6B | 171.0 (4) |
P2B—Pt1B—P1B—C31B | −24.60 (16) | Pt1B—P2B—C1B—C6B | 48.5 (4) |
Cl2B—Pt1B—P1B—C31B | 100.6 (2) | C6B—C1B—C2B—C3B | −2.4 (7) |
Cl1B—Pt1B—P1B—C31B | 161.81 (16) | P2B—C1B—C2B—C3B | −175.8 (4) |
P1B—Pt1B—P2B—C13B | −42.16 (17) | C1B—C2B—C3B—C4B | 1.7 (8) |
Cl2B—Pt1B—P2B—C13B | 147.97 (17) | C2B—C3B—C4B—C5B | 0.2 (8) |
P1B—Pt1B—P2B—C7B | 84.17 (15) | C3B—C4B—C5B—C6B | −1.4 (8) |
Cl2B—Pt1B—P2B—C7B | −85.69 (15) | C4B—C5B—C6B—C1B | 0.7 (8) |
P1B—Pt1B—P2B—C1B | −156.08 (15) | C2B—C1B—C6B—C5B | 1.2 (7) |
Cl2B—Pt1B—P2B—C1B | 34.05 (15) | P2B—C1B—C6B—C5B | 174.9 (4) |
C7A—P2A—C1A—C6A | 129.2 (3) | C13B—P2B—C7B—C8B | 22.6 (4) |
C13A—P2A—C1A—C6A | 14.0 (3) | C1B—P2B—C7B—C8B | 129.9 (4) |
Pt1A—P2A—C1A—C6A | −107.8 (3) | Pt1B—P2B—C7B—C8B | −105.7 (4) |
C7A—P2A—C1A—C2A | −45.9 (3) | C13B—P2B—C7B—C12B | −163.2 (3) |
C13A—P2A—C1A—C2A | −161.1 (3) | C1B—P2B—C7B—C12B | −56.0 (4) |
Pt1A—P2A—C1A—C2A | 77.1 (3) | Pt1B—P2B—C7B—C12B | 68.5 (3) |
C6A—C1A—C2A—C3A | −0.1 (6) | C12B—C7B—C8B—C9B | 0.5 (7) |
P2A—C1A—C2A—C3A | 175.2 (3) | P2B—C7B—C8B—C9B | 174.6 (4) |
C1A—C2A—C3A—C4A | −0.4 (6) | C7B—C8B—C9B—C10B | −0.6 (8) |
C2A—C3A—C4A—C5A | 0.7 (7) | C8B—C9B—C10B—C11B | −0.2 (9) |
C3A—C4A—C5A—C6A | −0.5 (7) | C9B—C10B—C11B—C12B | 0.9 (8) |
C2A—C1A—C6A—C5A | 0.4 (6) | C10B—C11B—C12B—C7B | −1.0 (7) |
P2A—C1A—C6A—C5A | −174.7 (3) | C8B—C7B—C12B—C11B | 0.3 (7) |
C4A—C5A—C6A—C1A | −0.1 (7) | P2B—C7B—C12B—C11B | −174.2 (4) |
C13A—P2A—C7A—C8A | −138.5 (3) | C7B—P2B—C13B—C14B | −156.4 (3) |
C1A—P2A—C7A—C8A | 112.6 (3) | C1B—P2B—C13B—C14B | 92.2 (4) |
Pt1A—P2A—C7A—C8A | −13.6 (3) | Pt1B—P2B—C13B—C14B | −29.9 (4) |
C13A—P2A—C7A—C12A | 47.1 (4) | C7B—P2B—C13B—C18B | 27.6 (5) |
C1A—P2A—C7A—C12A | −61.8 (3) | C1B—P2B—C13B—C18B | −83.7 (4) |
Pt1A—P2A—C7A—C12A | 172.0 (3) | Pt1B—P2B—C13B—C18B | 154.1 (4) |
C12A—C7A—C8A—C9A | −3.0 (6) | C18B—C13B—C14B—C15B | −3.7 (7) |
P2A—C7A—C8A—C9A | −177.6 (3) | P2B—C13B—C14B—C15B | −179.9 (4) |
C7A—C8A—C9A—C10A | −0.5 (6) | C13B—C14B—C15B—C16B | −0.2 (9) |
C8A—C9A—C10A—C11A | 3.2 (7) | C14B—C15B—C16B—C17B | 2.5 (11) |
C9A—C10A—C11A—C12A | −2.1 (7) | C15B—C16B—C17B—C18B | −0.9 (12) |
C10A—C11A—C12A—C7A | −1.5 (7) | C16B—C17B—C18B—C13B | −3.0 (11) |
C8A—C7A—C12A—C11A | 4.0 (6) | C14B—C13B—C18B—C17B | 5.2 (8) |
P2A—C7A—C12A—C11A | 178.5 (3) | P2B—C13B—C18B—C17B | −178.9 (5) |
C7A—P2A—C13A—C18A | −179.0 (3) | C25B—P1B—C19B—C20B | 66.2 (4) |
C1A—P2A—C13A—C18A | −72.4 (3) | C31B—P1B—C19B—C20B | −39.5 (4) |
Pt1A—P2A—C13A—C18A | 54.4 (3) | Pt1B—P1B—C19B—C20B | −171.9 (3) |
C7A—P2A—C13A—C14A | 2.8 (4) | C25B—P1B—C19B—C24B | −115.4 (4) |
C1A—P2A—C13A—C14A | 109.4 (3) | C31B—P1B—C19B—C24B | 138.9 (4) |
Pt1A—P2A—C13A—C14A | −123.8 (3) | Pt1B—P1B—C19B—C24B | 6.5 (4) |
C18A—C13A—C14A—C15A | 0.1 (6) | C24B—C19B—C20B—C21B | 1.3 (7) |
P2A—C13A—C14A—C15A | 178.2 (3) | P1B—C19B—C20B—C21B | 179.7 (4) |
C13A—C14A—C15A—C16A | 1.3 (7) | C19B—C20B—C21B—C22B | −2.2 (8) |
C14A—C15A—C16A—C17A | −0.8 (7) | C20B—C21B—C22B—C23B | 0.2 (9) |
C15A—C16A—C17A—C18A | −1.0 (7) | C21B—C22B—C23B—C24B | 2.6 (9) |
C16A—C17A—C18A—C13A | 2.4 (7) | C20B—C19B—C24B—C23B | 1.5 (7) |
C14A—C13A—C18A—C17A | −1.9 (6) | P1B—C19B—C24B—C23B | −177.0 (4) |
P2A—C13A—C18A—C17A | 179.8 (3) | C22B—C23B—C24B—C19B | −3.4 (8) |
C25A—P1A—C19A—C20A | 8.1 (4) | C19B—P1B—C25B—C26B | 162.3 (3) |
C31A—P1A—C19A—C20A | 112.5 (3) | C31B—P1B—C25B—C26B | −89.7 (4) |
Pt1A—P1A—C19A—C20A | −113.1 (3) | Pt1B—P1B—C25B—C26B | 35.5 (4) |
C25A—P1A—C19A—C24A | −172.6 (3) | C19B—P1B—C25B—C30B | −20.9 (4) |
C31A—P1A—C19A—C24A | −68.2 (3) | C31B—P1B—C25B—C30B | 87.2 (4) |
Pt1A—P1A—C19A—C24A | 66.2 (3) | Pt1B—P1B—C25B—C30B | −147.6 (3) |
C24A—C19A—C20A—C21A | 0.6 (6) | C30B—C25B—C26B—C27B | −2.3 (7) |
P1A—C19A—C20A—C21A | 179.9 (3) | P1B—C25B—C26B—C27B | 174.7 (4) |
C19A—C20A—C21A—C22A | −0.1 (7) | C25B—C26B—C27B—C28B | 0.1 (7) |
C20A—C21A—C22A—C23A | 0.3 (7) | C26B—C27B—C28B—C29B | 1.5 (7) |
C21A—C22A—C23A—C24A | −1.0 (7) | C27B—C28B—C29B—C30B | −0.9 (7) |
C20A—C19A—C24A—C23A | −1.3 (6) | C28B—C29B—C30B—C25B | −1.3 (7) |
P1A—C19A—C24A—C23A | 179.4 (3) | C26B—C25B—C30B—C29B | 2.9 (6) |
C22A—C23A—C24A—C19A | 1.5 (7) | P1B—C25B—C30B—C29B | −174.0 (3) |
C19A—P1A—C25A—C26A | −131.4 (3) | C19B—P1B—C31B—C32B | 151.0 (3) |
C31A—P1A—C25A—C26A | 120.5 (3) | C25B—P1B—C31B—C32B | 40.8 (4) |
Pt1A—P1A—C25A—C26A | −10.1 (3) | Pt1B—P1B—C31B—C32B | −77.7 (3) |
C19A—P1A—C25A—C30A | 53.5 (3) | C19B—P1B—C31B—C36B | −31.0 (4) |
C31A—P1A—C25A—C30A | −54.5 (3) | C25B—P1B—C31B—C36B | −141.1 (3) |
Pt1A—P1A—C25A—C30A | 174.9 (3) | Pt1B—P1B—C31B—C36B | 100.4 (3) |
C30A—C25A—C26A—C27A | −0.9 (5) | C36B—C31B—C32B—C33B | 1.1 (6) |
P1A—C25A—C26A—C27A | −176.0 (3) | P1B—C31B—C32B—C33B | 179.2 (3) |
C25A—C26A—C27A—C28A | −0.5 (6) | C31B—C32B—C33B—C34B | −0.8 (7) |
C26A—C27A—C28A—C29A | 0.5 (7) | C32B—C33B—C34B—C35B | 0.0 (8) |
C27A—C28A—C29A—C30A | 1.1 (6) | C33B—C34B—C35B—C36B | 0.6 (7) |
C28A—C29A—C30A—C25A | −2.5 (6) | C34B—C35B—C36B—C31B | −0.3 (7) |
C26A—C25A—C30A—C29A | 2.4 (5) | C32B—C31B—C36B—C35B | −0.5 (6) |
P1A—C25A—C30A—C29A | 177.5 (3) | P1B—C31B—C36B—C35B | −178.6 (3) |
C25A—P1A—C31A—C36A | −56.1 (3) |
D—H···A | D—H | H···A | D···A | D—H···A |
C11A—H11A···Cl2Ai | 0.93 | 2.75 | 3.486 (4) | 136 |
C8B—H8BA···Cg1 | 0.93 | 2.75 | 3.395 (6) | 127 |
C36B—H36B···Cg2 | 0.93 | 2.75 | 3.185 (6) | 110 |
Symmetry code: (i) x, −y+1/2, z+1/2. |
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