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The title compound, [PtCl2(C34H31NP2)], crystallizes with four crystallographically independent mol­ecules. All four mol­ecules have the same R chirality, with P—Pt—P bite angles ranging from 72.14 (5) to 72.38 (5)°.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806052044/bt2219sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536806052044/bt2219Isup2.hkl
Contains datablock I

CCDC reference: 633633

Key indicators

  • Single-crystal X-ray study
  • T = 150 K
  • Mean [sigma](C-C) = 0.009 Å
  • R factor = 0.034
  • wR factor = 0.054
  • Data-to-parameter ratio = 19.7

checkCIF/PLATON results

No syntax errors found



Alert level B PLAT220_ALERT_2_B Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.76 Ratio
Alert level C PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 2.68 Ratio PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 3.38 Ratio PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 9
Alert level G REFLT03_ALERT_4_G Please check that the estimate of the number of Friedel pairs is correct. If it is not, please give the correct count in the _publ_section_exptl_refinement section of the submitted CIF. From the CIF: _diffrn_reflns_theta_max 27.45 From the CIF: _reflns_number_total 28340 Count of symmetry unique reflns 14696 Completeness (_total/calc) 192.84% TEST3: Check Friedels for noncentro structure Estimate of Friedel pairs measured 13644 Fraction of Friedel pairs measured 0.928 Are heavy atom types Z>Si present yes PLAT791_ALERT_1_G Confirm the Absolute Configuration of C1 = . R PLAT791_ALERT_1_G Confirm the Absolute Configuration of C35 = . R PLAT791_ALERT_1_G Confirm the Absolute Configuration of C69 = . R PLAT791_ALERT_1_G Confirm the Absolute Configuration of C103 = . R
0 ALERT level A = In general: serious problem 1 ALERT level B = Potentially serious problem 3 ALERT level C = Check and explain 5 ALERT level G = General alerts; check 4 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 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check

Computing details top

Data collection: COLLECT (Hooft, 1998); cell refinement: DIRAX (Duisenberg, 1992); data reduction: EVALCCD (Duisenberg et al., 2003); program(s) used to solve structure: SHELXS86 (Sheldrick, 1985); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: PLATON (Spek, 2003); software used to prepare material for publication: PLATON.

[N,N-Bis(diphenylphosphanyl)-(R)-1,2,3,4-tetrahydro-1- naphthylamine-κ2P,P']dichloroplatinum(II) top
Crystal data top
[PtCl2(C34H31NP2)]F(000) = 3072
Mr = 781.53Dx = 1.672 Mg m3
Monoclinic, P21Mo Kα radiation, λ = 0.71073 Å
Hall symbol: P 2ybCell parameters from 399 reflections
a = 19.107 (1) Åθ = 3.7–22.4°
b = 15.9176 (7) ŵ = 4.82 mm1
c = 20.8122 (11) ÅT = 150 K
β = 101.266 (5)°Block, colourless
V = 6207.8 (5) Å30.33 × 0.13 × 0.06 mm
Z = 8
Data collection top
Nonius KappaCCD
diffractometer
28340 independent reflections
Radiation source: Rotating Anode21447 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.065
Detector resolution: 18.4 pixels mm-1θmax = 27.5°, θmin = 1.6°
φ and ω scansh = 2424
Absorption correction: multi-scan
(SADABS; Sheldrick, 2002)
k = 2020
Tmin = 0.44, Tmax = 0.75l = 2626
151899 measured reflections
Refinement top
Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.034H-atom parameters constrained
wR(F2) = 0.054 w = 1/[σ2(Fo2) + (0.0146P)2 + 3.8989P]
where P = (Fo2 + 2Fc2)/3
S = 1.02(Δ/σ)max = 0.002
28340 reflectionsΔρmax = 1.42 e Å3
1441 parametersΔρmin = 0.87 e Å3
1 restraintAbsolute structure: Flack (1983)
Primary atom site location: structure-invariant direct methodsAbsolute structure parameter: 0.021 (3)
Special details top

Geometry. Bond distances, angles etc. have been calculated using the rounded fractional coordinates. All su's are estimated from the variances of the (full) variance-covariance matrix. The cell e.s.d.'s are taken into account in the estimation of distances, angles and torsion angles

Refinement. Refinement on F2 for ALL reflections except those flagged by the user for potential systematic errors. Weighted R-factors wR and all goodnesses of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The observed criterion of F2 > σ(F2) is used only for calculating -R-factor-obs 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
Pt10.26058 (1)0.34624 (2)0.24145 (1)0.0154 (1)
Cl10.37002 (8)0.38303 (10)0.21276 (7)0.0248 (5)
Cl20.31780 (8)0.29968 (10)0.34632 (7)0.0267 (5)
P10.19337 (8)0.38076 (10)0.14647 (7)0.0154 (5)
P20.14822 (7)0.32432 (10)0.24862 (6)0.0163 (5)
N10.1150 (2)0.3577 (3)0.17060 (17)0.0148 (13)
C10.0384 (3)0.3669 (4)0.1381 (2)0.0209 (19)
C20.0178 (3)0.3006 (4)0.0848 (3)0.0298 (19)
C30.0571 (3)0.3178 (4)0.0454 (3)0.038 (2)
C40.0555 (3)0.4009 (4)0.0086 (3)0.039 (2)
C50.0237 (3)0.4721 (4)0.0533 (3)0.0297 (19)
C60.0197 (3)0.4571 (4)0.1154 (3)0.0216 (19)
C70.0434 (3)0.5242 (4)0.1564 (3)0.0263 (19)
C80.0280 (3)0.6068 (4)0.1361 (3)0.036 (2)
C90.0127 (3)0.6222 (4)0.0744 (3)0.041 (3)
C100.0380 (3)0.5553 (5)0.0333 (3)0.036 (3)
C110.2044 (3)0.3143 (4)0.0791 (2)0.0205 (19)
C120.1863 (3)0.2302 (4)0.0823 (3)0.0259 (17)
C130.2005 (3)0.1756 (4)0.0344 (3)0.036 (2)
C140.2312 (3)0.2035 (4)0.0167 (3)0.037 (3)
C150.2487 (3)0.2854 (4)0.0196 (3)0.037 (2)
C160.2370 (3)0.3414 (4)0.0287 (2)0.0293 (17)
C170.1930 (3)0.4888 (4)0.1206 (3)0.0180 (17)
C180.2195 (3)0.5483 (4)0.1670 (3)0.0252 (19)
C190.2121 (3)0.6331 (4)0.1522 (3)0.029 (2)
C200.1795 (3)0.6585 (4)0.0896 (3)0.027 (2)
C210.1548 (3)0.5983 (4)0.0419 (3)0.026 (2)
C220.1602 (3)0.5132 (4)0.0569 (3)0.0203 (17)
C230.1208 (3)0.2167 (4)0.2572 (2)0.0199 (17)
C240.1727 (3)0.1583 (4)0.2803 (3)0.027 (2)
C250.1559 (4)0.0739 (4)0.2843 (3)0.034 (2)
C260.0887 (4)0.0477 (4)0.2656 (3)0.038 (3)
C270.0345 (4)0.1044 (4)0.2426 (3)0.040 (2)
C280.0499 (3)0.1895 (4)0.2391 (3)0.0265 (17)
C290.1092 (3)0.3913 (4)0.3029 (2)0.0179 (19)
C300.0440 (3)0.3744 (4)0.3209 (2)0.0228 (19)
C310.0147 (3)0.4321 (4)0.3567 (3)0.031 (2)
C320.0498 (3)0.5060 (4)0.3756 (3)0.034 (3)
C330.1161 (3)0.5240 (4)0.3588 (3)0.034 (2)
C340.1458 (3)0.4652 (4)0.3235 (3)0.0291 (19)
Pt20.26526 (1)0.34810 (2)0.72977 (1)0.0145 (1)
Cl30.37268 (7)0.39334 (11)0.70052 (7)0.0280 (5)
Cl40.32601 (7)0.31012 (10)0.83520 (6)0.0261 (5)
P30.19101 (7)0.37631 (9)0.63637 (6)0.0142 (4)
P40.15723 (7)0.31422 (9)0.74210 (6)0.0138 (4)
N20.11664 (19)0.3487 (3)0.66608 (15)0.0143 (13)
C350.0382 (2)0.3453 (4)0.63799 (19)0.0168 (14)
C360.0183 (3)0.2606 (4)0.6036 (3)0.023 (2)
C370.0552 (3)0.2649 (4)0.5594 (3)0.034 (2)
C380.0547 (3)0.3312 (4)0.5059 (2)0.0315 (19)
C390.0301 (3)0.4144 (4)0.5343 (3)0.0217 (19)
C400.0113 (3)0.4216 (4)0.5973 (3)0.0175 (19)
C410.0263 (3)0.5009 (4)0.6254 (3)0.0251 (19)
C420.0033 (3)0.5734 (3)0.5911 (3)0.032 (2)
C430.0361 (3)0.5661 (4)0.5272 (3)0.031 (2)
C440.0524 (3)0.4884 (4)0.5003 (3)0.0288 (19)
C450.1974 (3)0.3111 (3)0.5662 (2)0.0140 (16)
C460.2520 (3)0.2544 (4)0.5723 (3)0.0234 (19)
C470.2571 (3)0.2001 (4)0.5215 (3)0.031 (2)
C480.2086 (4)0.2009 (4)0.4654 (3)0.034 (3)
C490.1522 (3)0.2590 (4)0.4576 (3)0.033 (2)
C500.1469 (3)0.3137 (4)0.5081 (2)0.0232 (17)
C510.1867 (3)0.4851 (4)0.6121 (2)0.0161 (17)
C520.1910 (3)0.5433 (4)0.6624 (3)0.0237 (19)
C530.1847 (3)0.6289 (4)0.6479 (3)0.0260 (19)
C540.1772 (3)0.6561 (4)0.5839 (3)0.026 (2)
C550.1760 (3)0.5980 (4)0.5349 (3)0.0238 (17)
C560.1805 (3)0.5130 (4)0.5478 (2)0.0187 (17)
C570.1407 (3)0.2038 (3)0.7491 (2)0.0158 (17)
C580.1471 (3)0.1535 (3)0.6963 (3)0.0226 (17)
C590.1387 (3)0.0657 (4)0.6997 (3)0.0300 (19)
C600.1257 (3)0.0311 (4)0.7571 (3)0.0265 (19)
C610.1219 (3)0.0794 (4)0.8096 (3)0.028 (2)
C620.1296 (3)0.1677 (4)0.8066 (3)0.026 (2)
C630.1176 (3)0.3695 (3)0.8010 (2)0.0142 (16)
C640.0485 (2)0.3507 (4)0.8108 (2)0.0197 (14)
C650.0164 (3)0.4002 (4)0.8511 (2)0.0249 (19)
C660.0516 (3)0.4681 (4)0.8821 (3)0.030 (2)
C670.1200 (3)0.4878 (4)0.8732 (3)0.028 (2)
C680.1525 (3)0.4379 (4)0.8330 (2)0.0221 (19)
Pt30.76090 (1)0.33169 (1)0.24629 (1)0.0135 (1)
Cl50.86932 (8)0.28920 (10)0.21723 (7)0.0261 (5)
Cl60.81955 (7)0.36542 (9)0.35365 (6)0.0214 (4)
P50.69155 (7)0.30738 (9)0.15036 (6)0.0143 (5)
P60.65016 (7)0.36232 (10)0.25495 (6)0.0135 (5)
N30.61680 (19)0.3459 (3)0.17361 (15)0.0141 (13)
C690.5426 (3)0.3588 (4)0.1363 (2)0.0175 (18)
C700.5098 (3)0.2752 (4)0.1104 (3)0.027 (2)
C710.4369 (3)0.2903 (4)0.0653 (3)0.034 (2)
C720.4501 (3)0.3378 (6)0.0045 (2)0.046 (3)
C730.4963 (3)0.4125 (4)0.0209 (3)0.035 (2)
C740.5391 (3)0.4263 (4)0.0824 (3)0.0256 (19)
C750.5783 (3)0.4989 (4)0.0954 (3)0.030 (2)
C760.5782 (4)0.5590 (4)0.0473 (4)0.044 (3)
C770.5372 (4)0.5463 (6)0.0141 (4)0.059 (3)
C780.4972 (4)0.4764 (5)0.0265 (3)0.050 (3)
C790.6818 (3)0.1976 (4)0.1281 (2)0.0167 (17)
C800.6575 (3)0.1421 (4)0.1713 (3)0.0217 (19)
C810.6549 (3)0.0564 (4)0.1594 (3)0.029 (2)
C820.6772 (3)0.0267 (4)0.1045 (3)0.030 (2)
C830.7011 (3)0.0796 (4)0.0615 (3)0.029 (2)
C840.7047 (3)0.1661 (4)0.0736 (3)0.0213 (17)
C850.7078 (3)0.3636 (4)0.0804 (2)0.0167 (18)
C860.7626 (3)0.4220 (4)0.0886 (3)0.0228 (19)
C870.7725 (3)0.4724 (4)0.0365 (3)0.031 (2)
C880.7262 (3)0.4645 (4)0.0239 (3)0.029 (2)
C890.6717 (3)0.4071 (4)0.0325 (3)0.026 (2)
C900.6623 (3)0.3555 (4)0.0187 (2)0.0203 (16)
C910.6082 (3)0.2915 (4)0.3036 (2)0.0157 (17)
C920.5344 (3)0.2859 (4)0.3011 (3)0.0249 (19)
C930.5082 (3)0.2285 (4)0.3400 (3)0.034 (3)
C940.5525 (3)0.1759 (4)0.3816 (3)0.034 (2)
C950.6257 (3)0.1817 (4)0.3849 (3)0.038 (3)
C960.6539 (3)0.2385 (4)0.3471 (3)0.0255 (19)
C970.6301 (3)0.4692 (3)0.2751 (2)0.0165 (17)
C980.6773 (3)0.5301 (4)0.2637 (3)0.033 (2)
C990.6652 (3)0.6144 (4)0.2758 (3)0.041 (3)
C1000.6063 (3)0.6368 (4)0.3007 (3)0.029 (2)
C1010.5601 (4)0.5761 (4)0.3134 (3)0.039 (3)
C1020.5715 (3)0.4916 (4)0.3006 (3)0.031 (2)
Pt40.23842 (1)0.83716 (2)0.24990 (1)0.0157 (1)
Cl70.12980 (8)0.79129 (11)0.27604 (7)0.0307 (5)
Cl80.17972 (7)0.87803 (10)0.14418 (6)0.0268 (5)
P70.30760 (7)0.80968 (9)0.34595 (6)0.0147 (5)
P80.34942 (7)0.87032 (10)0.24329 (6)0.0146 (5)
N40.38138 (19)0.8523 (3)0.32450 (16)0.0139 (13)
C1030.4538 (3)0.8723 (3)0.3645 (2)0.0171 (17)
C1040.4902 (3)0.7933 (4)0.3965 (3)0.0249 (19)
C1050.5585 (3)0.8176 (4)0.4442 (2)0.0262 (19)
C1060.5406 (3)0.8676 (4)0.4999 (2)0.0284 (19)
C1070.4922 (3)0.9405 (4)0.4772 (3)0.0269 (19)
C1080.4498 (3)0.9431 (4)0.4140 (2)0.0184 (17)
C1090.4056 (3)1.0126 (3)0.3952 (3)0.0224 (17)
C1100.4020 (3)1.0783 (3)0.4392 (3)0.029 (2)
C1110.4432 (3)1.0750 (4)0.5014 (3)0.037 (3)
C1120.4876 (3)1.0075 (4)0.5197 (3)0.033 (2)
C1130.3226 (3)0.7002 (4)0.3646 (3)0.0207 (19)
C1140.3501 (3)0.6505 (4)0.3201 (3)0.027 (2)
C1150.3553 (3)0.5645 (4)0.3281 (3)0.033 (2)
C1160.3332 (3)0.5270 (4)0.3806 (3)0.031 (2)
C1170.3062 (3)0.5735 (4)0.4247 (3)0.035 (2)
C1180.3007 (3)0.6615 (4)0.4172 (3)0.027 (2)
C1190.2882 (3)0.8617 (4)0.4177 (2)0.0179 (18)
C1200.2306 (3)0.9152 (4)0.4101 (3)0.0237 (17)
C1210.2190 (4)0.9629 (4)0.4635 (3)0.039 (3)
C1220.2633 (4)0.9562 (5)0.5232 (3)0.045 (3)
C1230.3208 (4)0.9001 (4)0.5314 (3)0.039 (2)
C1240.3331 (3)0.8530 (4)0.4789 (2)0.0262 (16)
C1250.3932 (3)0.8001 (4)0.1951 (2)0.0168 (17)
C1260.3491 (3)0.7554 (4)0.1455 (3)0.0229 (19)
C1270.3774 (3)0.6969 (4)0.1084 (3)0.030 (2)
C1280.4504 (3)0.6835 (4)0.1201 (3)0.034 (2)
C1290.4948 (3)0.7299 (4)0.1674 (3)0.028 (2)
C1300.4668 (3)0.7870 (4)0.2058 (3)0.0218 (19)
C1310.3692 (3)0.9767 (4)0.2221 (2)0.0172 (17)
C1320.3151 (3)1.0359 (4)0.2142 (3)0.0244 (19)
C1330.3292 (3)1.1194 (4)0.2022 (3)0.029 (2)
C1340.3968 (3)1.1442 (4)0.1985 (3)0.034 (2)
C1350.4506 (4)1.0855 (4)0.2048 (3)0.039 (3)
C1360.4377 (3)1.0013 (4)0.2163 (3)0.031 (2)
H10.009800.354300.172400.0250*
H2A0.019100.244200.105100.0360*
H2B0.052500.301300.055200.0360*
H3A0.091600.321400.075100.0450*
H3B0.072100.271600.013900.0450*
H4A0.027300.393400.026100.0460*
H4B0.104800.416100.012900.0460*
H70.070500.513800.199100.0310*
H80.045300.652300.164300.0420*
H90.023400.678300.060200.0500*
H100.065500.566400.009000.0430*
H120.164600.210200.116700.0310*
H130.188900.117800.036700.0430*
H140.239900.165500.049400.0440*
H150.269200.305100.054900.0440*
H160.251400.398300.027100.0350*
H180.243000.531100.209500.0300*
H190.229300.673900.184800.0350*
H200.174200.716600.079300.0320*
H210.134000.615600.001400.0310*
H220.142000.472300.024800.0250*
H240.220800.176000.293700.0320*
H250.192500.034500.300500.0410*
H260.077800.010300.268200.0450*
H270.013200.085100.229100.0480*
H280.012800.228900.224600.0320*
H300.019900.323000.308300.0270*
H310.029900.420900.368600.0370*
H320.028900.545700.400400.0400*
H330.139800.575500.371500.0410*
H340.191400.475100.313200.0350*
H350.013800.346300.676400.0200*
H36A0.054300.245700.577200.0270*
H36B0.018500.216100.636900.0270*
H37A0.091400.279800.585600.0400*
H37B0.067800.209300.539000.0400*
H38A0.022800.312300.476600.0380*
H38B0.103400.336900.479300.0380*
H410.052800.505000.669000.0300*
H420.014000.627100.610500.0380*
H430.051500.615200.502400.0380*
H440.079900.484700.457100.0340*
H460.286800.252200.611700.0280*
H470.295700.161500.526500.0370*
H480.212400.162500.431200.0400*
H490.117900.260800.417800.0390*
H500.108800.352900.503200.0280*
H520.198100.524800.706700.0280*
H530.185700.668600.682200.0320*
H540.172800.714300.573900.0310*
H550.172000.616900.491000.0290*
H560.179400.473800.513200.0230*
H580.157300.178200.657600.0270*
H590.142000.031000.663300.0360*
H600.119100.027900.759600.0320*
H610.114200.053900.848900.0340*
H620.127100.201700.843600.0310*
H640.023800.303500.789500.0240*
H650.030300.387200.857300.0300*
H660.029300.501900.909900.0350*
H670.144300.535200.894600.0340*
H680.199400.451100.827300.0270*
H690.513800.380200.168200.0210*
H70A0.503700.238900.147500.0320*
H70B0.542000.246100.085700.0320*
H71A0.413100.236000.052200.0410*
H71B0.405900.323800.088400.0410*
H72A0.472600.299100.022700.0550*
H72B0.403600.355800.021800.0550*
H750.605800.508000.138100.0360*
H760.606200.608400.056600.0530*
H770.537100.586800.047700.0710*
H780.468300.469500.068800.0600*
H800.642700.163500.209200.0260*
H810.638100.018900.188500.0350*
H820.675900.032000.096200.0360*
H830.715200.057600.023600.0350*
H840.722600.202900.044700.0260*
H860.793500.427700.130000.0270*
H870.810500.511800.041900.0370*
H880.732400.499300.059400.0350*
H890.640200.402700.073800.0310*
H900.625200.314700.012200.0240*
H920.502600.321600.272600.0300*
H930.458200.225300.338000.0410*
H940.533500.136200.407600.0410*
H950.656900.145800.413800.0460*
H960.704100.242100.350300.0310*
H980.718500.514500.247300.0400*
H990.697400.656200.266900.0490*
H1000.597700.694200.309000.0350*
H1010.519700.591600.331100.0470*
H1020.539100.449900.309400.0370*
H10A0.501800.755300.362400.0300*
H10B0.457700.763300.420300.0300*
H10C0.585000.766300.461300.0320*
H10D0.589400.851300.421000.0320*
H10E0.517200.830300.527500.0340*
H10F0.585300.888900.527400.0340*
H1030.483600.893600.333500.0210*
H1090.377801.015200.352100.0270*
H1100.371301.124800.426200.0340*
H1110.440801.119200.531600.0450*
H1120.516101.006400.562600.0400*
H1140.365500.676200.284000.0320*
H1150.373900.531200.297500.0390*
H1160.337000.467800.385900.0380*
H1170.291200.546900.460500.0420*
H1180.281900.694200.448000.0330*
H1200.199000.919700.368900.0290*
H1210.179701.000500.458200.0470*
H1220.255200.989300.559000.0540*
H1230.351400.894400.573000.0470*
H1240.371900.814700.484500.0320*
H1260.299100.765200.137000.0280*
H1270.346900.666000.075200.0360*
H1280.470000.642400.095700.0400*
H1290.545000.722600.173600.0330*
H1300.497600.817100.239300.0260*
H1320.268101.019300.217000.0290*
H1330.291601.159400.196500.0350*
H1340.406601.201700.191700.0410*
H1350.497301.102700.201300.0470*
H1360.475000.961100.220100.0360*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Pt10.0116 (1)0.0162 (2)0.0176 (1)0.0015 (1)0.0008 (1)0.0009 (2)
Cl10.0156 (8)0.0266 (10)0.0339 (8)0.0010 (7)0.0088 (6)0.0018 (7)
Cl20.0246 (9)0.0279 (10)0.0233 (7)0.0037 (7)0.0058 (6)0.0034 (6)
P10.0156 (8)0.0151 (9)0.0156 (7)0.0002 (6)0.0032 (6)0.0008 (6)
P20.0142 (7)0.0191 (10)0.0156 (6)0.0002 (7)0.0029 (5)0.0003 (6)
N10.012 (2)0.020 (3)0.0119 (18)0.003 (2)0.0015 (16)0.001 (2)
C10.015 (3)0.028 (4)0.019 (3)0.004 (3)0.002 (2)0.005 (2)
C20.020 (3)0.036 (4)0.031 (3)0.004 (3)0.001 (3)0.011 (3)
C30.025 (3)0.064 (5)0.021 (3)0.005 (3)0.003 (2)0.011 (3)
C40.023 (4)0.072 (5)0.017 (3)0.002 (3)0.005 (3)0.006 (3)
C50.014 (3)0.053 (4)0.025 (3)0.006 (3)0.011 (2)0.008 (3)
C60.009 (3)0.041 (4)0.015 (3)0.002 (3)0.003 (2)0.002 (3)
C70.020 (3)0.032 (4)0.027 (3)0.007 (3)0.005 (3)0.002 (3)
C80.026 (4)0.032 (4)0.053 (4)0.002 (3)0.019 (3)0.002 (3)
C90.034 (4)0.034 (4)0.061 (5)0.015 (3)0.022 (4)0.024 (4)
C100.021 (4)0.053 (5)0.033 (4)0.011 (3)0.006 (3)0.017 (3)
C110.018 (3)0.023 (4)0.022 (3)0.000 (3)0.008 (2)0.005 (2)
C120.020 (3)0.028 (3)0.030 (3)0.001 (3)0.006 (3)0.011 (3)
C130.027 (4)0.024 (4)0.055 (4)0.004 (3)0.005 (3)0.019 (3)
C140.037 (4)0.035 (5)0.042 (4)0.002 (3)0.019 (3)0.023 (3)
C150.035 (4)0.053 (5)0.027 (3)0.006 (3)0.017 (3)0.007 (3)
C160.029 (3)0.031 (3)0.030 (3)0.004 (3)0.011 (2)0.008 (3)
C170.015 (3)0.014 (3)0.025 (3)0.000 (3)0.004 (2)0.000 (2)
C180.023 (3)0.032 (4)0.019 (3)0.000 (3)0.000 (2)0.002 (3)
C190.029 (4)0.022 (4)0.034 (3)0.009 (3)0.002 (3)0.002 (3)
C200.019 (4)0.019 (4)0.041 (4)0.002 (3)0.000 (3)0.006 (3)
C210.030 (4)0.029 (4)0.019 (3)0.001 (3)0.005 (3)0.005 (3)
C220.022 (3)0.022 (3)0.019 (3)0.002 (3)0.009 (2)0.001 (2)
C230.022 (3)0.018 (3)0.019 (3)0.004 (3)0.002 (2)0.000 (2)
C240.026 (4)0.026 (4)0.030 (3)0.001 (3)0.010 (3)0.001 (3)
C250.036 (4)0.016 (4)0.053 (4)0.006 (3)0.013 (3)0.009 (3)
C260.049 (5)0.018 (4)0.052 (4)0.002 (3)0.023 (4)0.009 (3)
C270.042 (4)0.041 (4)0.040 (4)0.023 (3)0.013 (3)0.004 (3)
C280.025 (3)0.023 (3)0.031 (3)0.006 (3)0.004 (3)0.001 (3)
C290.021 (3)0.023 (4)0.010 (3)0.006 (3)0.004 (2)0.004 (2)
C300.018 (3)0.028 (4)0.022 (3)0.001 (3)0.003 (2)0.004 (2)
C310.019 (3)0.046 (5)0.030 (3)0.002 (3)0.010 (3)0.005 (3)
C320.033 (4)0.039 (5)0.033 (4)0.006 (3)0.014 (3)0.014 (3)
C330.036 (4)0.039 (4)0.027 (3)0.007 (3)0.008 (3)0.018 (3)
C340.021 (3)0.040 (4)0.026 (3)0.007 (3)0.004 (3)0.015 (3)
Pt20.0113 (1)0.0183 (1)0.0136 (1)0.0008 (1)0.0015 (1)0.0025 (1)
Cl30.0144 (8)0.0434 (11)0.0273 (8)0.0037 (7)0.0069 (6)0.0002 (7)
Cl40.0216 (8)0.0397 (10)0.0157 (6)0.0071 (7)0.0004 (6)0.0003 (6)
P30.0137 (8)0.0159 (9)0.0126 (6)0.0005 (6)0.0019 (6)0.0017 (6)
P40.0136 (7)0.0154 (9)0.0121 (6)0.0006 (6)0.0017 (5)0.0016 (5)
N20.011 (2)0.021 (3)0.0103 (17)0.002 (3)0.0003 (15)0.000 (3)
C350.010 (2)0.025 (3)0.014 (2)0.007 (3)0.0009 (18)0.001 (3)
C360.019 (4)0.025 (4)0.022 (4)0.006 (3)0.003 (3)0.001 (3)
C370.028 (4)0.032 (4)0.036 (4)0.011 (3)0.006 (3)0.000 (3)
C380.025 (3)0.040 (4)0.025 (3)0.005 (3)0.006 (2)0.001 (3)
C390.016 (3)0.029 (4)0.020 (3)0.005 (3)0.003 (2)0.000 (3)
C400.013 (3)0.023 (4)0.017 (3)0.004 (3)0.004 (3)0.003 (3)
C410.017 (3)0.035 (4)0.024 (3)0.003 (3)0.006 (2)0.005 (3)
C420.024 (3)0.019 (4)0.056 (4)0.007 (3)0.018 (3)0.002 (3)
C430.027 (4)0.029 (4)0.041 (4)0.017 (3)0.015 (3)0.018 (3)
C440.019 (3)0.044 (4)0.024 (3)0.008 (3)0.006 (2)0.010 (3)
C450.015 (3)0.015 (3)0.011 (2)0.000 (2)0.000 (2)0.001 (2)
C460.021 (3)0.030 (4)0.018 (3)0.002 (3)0.001 (2)0.003 (2)
C470.033 (4)0.034 (4)0.027 (3)0.004 (3)0.008 (3)0.009 (3)
C480.050 (5)0.025 (4)0.032 (4)0.004 (3)0.022 (3)0.012 (3)
C490.050 (4)0.034 (4)0.012 (3)0.012 (3)0.001 (3)0.004 (3)
C500.031 (3)0.019 (3)0.020 (3)0.003 (3)0.006 (2)0.001 (2)
C510.015 (3)0.015 (3)0.019 (3)0.002 (3)0.005 (2)0.002 (2)
C520.029 (4)0.020 (3)0.021 (3)0.001 (3)0.002 (3)0.002 (2)
C530.035 (4)0.015 (3)0.028 (3)0.005 (3)0.006 (3)0.009 (3)
C540.027 (4)0.019 (4)0.031 (3)0.005 (3)0.002 (3)0.005 (3)
C550.023 (3)0.024 (3)0.023 (3)0.002 (3)0.001 (3)0.007 (3)
C560.020 (3)0.022 (3)0.014 (3)0.003 (3)0.003 (2)0.003 (2)
C570.013 (3)0.016 (3)0.016 (3)0.000 (2)0.003 (2)0.003 (2)
C580.023 (3)0.025 (3)0.020 (3)0.000 (2)0.005 (2)0.001 (2)
C590.026 (3)0.022 (3)0.039 (4)0.001 (3)0.001 (3)0.002 (3)
C600.023 (3)0.019 (3)0.037 (4)0.003 (3)0.005 (3)0.007 (3)
C610.025 (4)0.025 (4)0.037 (4)0.006 (3)0.011 (3)0.011 (3)
C620.032 (4)0.024 (4)0.025 (3)0.004 (3)0.015 (3)0.001 (3)
C630.014 (3)0.018 (3)0.009 (2)0.001 (2)0.002 (2)0.002 (2)
C640.014 (2)0.029 (3)0.015 (2)0.001 (3)0.0002 (18)0.002 (3)
C650.016 (3)0.044 (4)0.015 (3)0.001 (3)0.004 (2)0.006 (3)
C660.029 (4)0.039 (4)0.025 (3)0.010 (3)0.015 (3)0.008 (3)
C670.032 (4)0.031 (4)0.023 (3)0.007 (3)0.007 (3)0.013 (3)
C680.021 (3)0.033 (4)0.013 (3)0.004 (3)0.005 (2)0.005 (2)
Pt30.0106 (1)0.0142 (2)0.0150 (1)0.0001 (1)0.0008 (1)0.0016 (1)
Cl50.0151 (8)0.0319 (10)0.0328 (8)0.0058 (7)0.0081 (7)0.0012 (7)
Cl60.0210 (7)0.0243 (9)0.0163 (6)0.0045 (6)0.0030 (5)0.0024 (6)
P50.0129 (8)0.0148 (9)0.0147 (7)0.0005 (6)0.0018 (6)0.0008 (6)
P60.0107 (7)0.0153 (10)0.0142 (6)0.0028 (6)0.0016 (5)0.0007 (6)
N30.011 (2)0.019 (3)0.0113 (17)0.000 (3)0.0001 (15)0.003 (3)
C690.012 (3)0.027 (4)0.012 (2)0.005 (3)0.001 (2)0.002 (2)
C700.022 (4)0.026 (4)0.029 (3)0.003 (3)0.006 (3)0.004 (3)
C710.016 (3)0.052 (5)0.030 (3)0.007 (3)0.005 (3)0.008 (3)
C720.019 (3)0.093 (7)0.022 (3)0.003 (5)0.005 (2)0.001 (5)
C730.024 (4)0.058 (5)0.023 (3)0.012 (3)0.006 (3)0.014 (3)
C740.020 (3)0.032 (4)0.027 (3)0.008 (3)0.010 (3)0.012 (3)
C750.030 (4)0.023 (4)0.040 (4)0.013 (3)0.013 (3)0.009 (3)
C760.045 (5)0.028 (4)0.067 (5)0.015 (3)0.032 (4)0.022 (4)
C770.047 (5)0.073 (6)0.061 (5)0.021 (5)0.020 (4)0.046 (5)
C780.029 (4)0.091 (7)0.030 (4)0.024 (4)0.003 (3)0.029 (4)
C790.011 (3)0.016 (3)0.021 (3)0.000 (3)0.002 (2)0.002 (2)
C800.020 (3)0.022 (4)0.023 (3)0.001 (3)0.004 (3)0.005 (3)
C810.025 (4)0.019 (4)0.041 (4)0.001 (3)0.004 (3)0.007 (3)
C820.019 (4)0.015 (4)0.052 (4)0.004 (3)0.001 (3)0.003 (3)
C830.030 (4)0.024 (4)0.032 (4)0.007 (3)0.004 (3)0.010 (3)
C840.022 (3)0.016 (3)0.024 (3)0.002 (3)0.000 (3)0.004 (2)
C850.019 (3)0.016 (4)0.016 (2)0.002 (3)0.006 (2)0.001 (2)
C860.023 (3)0.023 (4)0.021 (3)0.002 (3)0.001 (3)0.004 (3)
C870.031 (4)0.029 (4)0.033 (4)0.008 (3)0.010 (3)0.010 (3)
C880.042 (4)0.030 (4)0.019 (3)0.001 (3)0.014 (3)0.015 (3)
C890.040 (4)0.024 (4)0.014 (3)0.005 (3)0.007 (3)0.002 (2)
C900.027 (3)0.013 (3)0.021 (2)0.001 (3)0.005 (2)0.003 (3)
C910.013 (3)0.015 (3)0.019 (3)0.005 (2)0.003 (2)0.002 (2)
C920.023 (3)0.025 (4)0.026 (3)0.001 (3)0.003 (3)0.002 (3)
C930.018 (4)0.047 (5)0.039 (4)0.011 (3)0.012 (3)0.004 (3)
C940.027 (4)0.047 (5)0.029 (3)0.008 (3)0.008 (3)0.017 (3)
C950.030 (4)0.048 (5)0.036 (4)0.002 (3)0.004 (3)0.023 (3)
C960.016 (3)0.030 (4)0.030 (3)0.000 (3)0.003 (3)0.010 (3)
C970.021 (3)0.013 (3)0.013 (3)0.003 (3)0.003 (2)0.002 (2)
C980.016 (3)0.024 (4)0.064 (5)0.004 (3)0.018 (3)0.006 (3)
C990.030 (4)0.024 (4)0.070 (5)0.007 (3)0.013 (4)0.010 (3)
C1000.029 (4)0.016 (4)0.038 (4)0.003 (3)0.002 (3)0.009 (3)
C1010.045 (5)0.033 (5)0.044 (4)0.015 (3)0.022 (4)0.005 (3)
C1020.040 (4)0.018 (3)0.039 (4)0.001 (3)0.020 (3)0.002 (3)
Pt40.0110 (1)0.0182 (2)0.0174 (1)0.0002 (1)0.0014 (1)0.0005 (1)
Cl70.0155 (8)0.0448 (12)0.0320 (8)0.0070 (8)0.0052 (7)0.0046 (8)
Cl80.0191 (8)0.0388 (11)0.0201 (7)0.0017 (7)0.0020 (6)0.0041 (6)
P70.0145 (8)0.0135 (9)0.0161 (7)0.0007 (6)0.0030 (6)0.0006 (6)
P80.0110 (7)0.0176 (10)0.0148 (6)0.0006 (6)0.0018 (6)0.0001 (6)
N40.016 (2)0.016 (3)0.0103 (17)0.003 (2)0.0042 (16)0.001 (2)
C1030.017 (3)0.019 (3)0.016 (3)0.001 (2)0.005 (2)0.000 (2)
C1040.030 (4)0.021 (3)0.022 (3)0.004 (3)0.001 (3)0.003 (2)
C1050.017 (3)0.033 (4)0.025 (3)0.006 (3)0.005 (2)0.003 (3)
C1060.023 (3)0.036 (4)0.023 (3)0.000 (3)0.003 (2)0.004 (3)
C1070.021 (3)0.038 (4)0.022 (3)0.007 (3)0.005 (3)0.008 (3)
C1080.015 (3)0.024 (3)0.018 (3)0.010 (3)0.008 (2)0.005 (2)
C1090.025 (3)0.018 (3)0.023 (3)0.003 (3)0.002 (2)0.003 (2)
C1100.031 (4)0.016 (4)0.042 (4)0.003 (3)0.015 (3)0.005 (3)
C1110.038 (4)0.035 (5)0.038 (4)0.011 (3)0.007 (3)0.024 (3)
C1120.023 (4)0.052 (5)0.024 (3)0.010 (3)0.004 (3)0.015 (3)
C1130.013 (3)0.020 (4)0.026 (3)0.003 (3)0.004 (2)0.002 (3)
C1140.034 (4)0.019 (4)0.025 (3)0.004 (3)0.000 (3)0.003 (3)
C1150.036 (4)0.020 (3)0.036 (4)0.004 (3)0.008 (3)0.007 (3)
C1160.030 (4)0.013 (3)0.043 (4)0.006 (3)0.012 (3)0.007 (3)
C1170.033 (4)0.029 (4)0.043 (4)0.003 (3)0.006 (3)0.012 (3)
C1180.022 (4)0.030 (4)0.032 (4)0.005 (3)0.010 (3)0.001 (3)
C1190.024 (3)0.015 (4)0.018 (2)0.005 (3)0.012 (2)0.000 (2)
C1200.022 (3)0.020 (3)0.031 (3)0.001 (3)0.010 (3)0.001 (3)
C1210.041 (4)0.025 (4)0.062 (5)0.003 (3)0.038 (4)0.004 (3)
C1220.073 (6)0.036 (5)0.037 (4)0.014 (4)0.035 (4)0.008 (3)
C1230.062 (5)0.040 (4)0.020 (3)0.012 (4)0.019 (3)0.004 (3)
C1240.034 (3)0.027 (3)0.019 (2)0.006 (3)0.009 (2)0.002 (3)
C1250.015 (3)0.017 (3)0.017 (3)0.001 (3)0.000 (2)0.003 (2)
C1260.017 (3)0.027 (4)0.024 (3)0.003 (3)0.002 (3)0.002 (3)
C1270.037 (4)0.027 (4)0.021 (3)0.004 (3)0.005 (3)0.004 (3)
C1280.039 (4)0.038 (5)0.027 (3)0.005 (4)0.015 (3)0.004 (3)
C1290.022 (4)0.029 (4)0.035 (4)0.002 (3)0.011 (3)0.004 (3)
C1300.013 (3)0.028 (4)0.023 (3)0.001 (3)0.000 (2)0.005 (3)
C1310.019 (3)0.022 (3)0.011 (3)0.003 (3)0.004 (2)0.000 (2)
C1320.019 (3)0.027 (4)0.027 (3)0.004 (3)0.004 (3)0.002 (3)
C1330.030 (4)0.018 (4)0.038 (4)0.009 (3)0.005 (3)0.007 (3)
C1340.037 (4)0.023 (4)0.045 (4)0.009 (3)0.013 (3)0.007 (3)
C1350.030 (4)0.030 (4)0.064 (5)0.007 (3)0.024 (4)0.008 (3)
C1360.024 (3)0.029 (4)0.042 (4)0.008 (3)0.014 (3)0.002 (3)
Geometric parameters (Å, º) top
Pt1—Cl12.3580 (16)C43—H430.9500
Pt1—Cl22.3613 (15)C44—H440.9500
Pt1—P12.2061 (15)C46—H460.9500
Pt1—P22.2087 (14)C47—H470.9500
Pt2—Cl32.3644 (14)C48—H480.9500
Pt2—Cl42.3521 (13)C49—H490.9500
Pt2—P32.2171 (13)C50—H500.9500
Pt2—P42.1964 (14)C52—H520.9500
Pt3—Cl52.3673 (16)C53—H530.9500
Pt3—Cl62.3577 (13)C54—H540.9500
Pt3—P62.2128 (14)C55—H550.9500
Pt3—P52.2040 (13)C56—H560.9500
Pt4—P82.2158 (14)C58—H580.9500
Pt4—Cl82.3575 (13)C59—H590.9500
Pt4—Cl72.3617 (16)C60—H600.9500
Pt4—P72.2142 (13)C61—H610.9500
P1—C111.801 (5)C62—H620.9500
P1—N11.710 (4)C64—H640.9500
P1—C171.802 (7)C65—H650.9500
P2—N11.709 (4)C66—H660.9500
P2—C231.810 (6)C67—H670.9500
P2—C291.816 (6)C68—H680.9500
P3—N21.714 (4)C69—C741.545 (8)
P3—C451.815 (5)C69—C701.524 (9)
P3—C511.801 (6)C70—C711.539 (8)
P4—N21.711 (4)C71—C721.537 (9)
P4—C571.797 (5)C72—C731.481 (10)
P4—C631.793 (5)C73—C741.395 (9)
P5—C791.808 (6)C73—C781.419 (10)
P5—C851.787 (5)C74—C751.375 (9)
P5—N31.709 (4)C75—C761.384 (10)
P6—N31.708 (3)C76—C771.377 (11)
P6—C911.804 (6)C77—C781.346 (12)
P6—C971.811 (5)C79—C801.403 (8)
P7—N41.701 (4)C79—C841.387 (8)
P7—C1131.796 (7)C80—C811.386 (9)
P7—C1191.808 (5)C81—C821.379 (9)
P8—C1311.808 (6)C82—C831.371 (9)
P8—N41.705 (4)C83—C841.399 (9)
P8—C1251.812 (6)C85—C901.409 (6)
N1—C11.495 (7)C85—C861.386 (9)
N2—C351.500 (5)C86—C871.391 (9)
N3—C691.492 (6)C87—C881.394 (9)
N4—C1031.503 (6)C88—C891.371 (9)
C1—C21.526 (8)C89—C901.385 (8)
C1—C61.532 (9)C91—C921.404 (8)
C2—C31.529 (8)C91—C961.409 (8)
C3—C41.532 (9)C92—C931.378 (9)
C4—C51.516 (9)C93—C941.371 (9)
C5—C61.413 (9)C94—C951.390 (8)
C5—C101.399 (10)C95—C961.376 (9)
C6—C71.387 (9)C97—C1021.377 (8)
C7—C81.395 (9)C97—C981.376 (8)
C8—C91.387 (9)C98—C991.393 (9)
C9—C101.392 (10)C99—C1001.375 (8)
C11—C161.389 (7)C100—C1011.369 (9)
C11—C121.388 (9)C101—C1021.397 (9)
C12—C131.389 (9)C69—H691.0000
C13—C141.384 (9)C70—H70B0.9900
C14—C151.350 (9)C70—H70A0.9900
C15—C161.394 (8)C71—H71A0.9900
C17—C221.406 (9)C71—H71B0.9900
C17—C181.377 (9)C72—H72B0.9900
C18—C191.386 (9)C72—H72A0.9900
C19—C201.390 (9)C75—H750.9500
C20—C211.394 (9)C76—H760.9500
C21—C221.389 (9)C77—H770.9500
C23—C281.402 (8)C78—H780.9500
C23—C241.376 (9)C80—H800.9500
C24—C251.388 (9)C81—H810.9500
C25—C261.334 (11)C82—H820.9500
C26—C271.387 (10)C83—H830.9500
C27—C281.391 (9)C84—H840.9500
C29—C301.395 (8)C86—H860.9500
C29—C341.393 (9)C87—H870.9500
C30—C311.369 (8)C88—H880.9500
C31—C321.373 (9)C89—H890.9500
C32—C331.408 (8)C90—H900.9500
C33—C341.379 (9)C92—H920.9500
C1—H11.0000C93—H930.9500
C2—H2A0.9900C94—H940.9500
C2—H2B0.9900C95—H950.9500
C3—H3A0.9900C96—H960.9500
C3—H3B0.9900C98—H980.9500
C4—H4A0.9900C99—H990.9500
C4—H4B0.9900C100—H1000.9500
C7—H70.9500C101—H1010.9500
C8—H80.9500C102—H1020.9500
C9—H90.9500C103—C1041.526 (8)
C10—H100.9500C103—C1081.539 (7)
C12—H120.9500C104—C1051.527 (8)
C13—H130.9500C105—C1061.500 (7)
C14—H140.9500C106—C1071.501 (9)
C15—H150.9500C107—C1081.404 (8)
C16—H160.9500C107—C1121.399 (9)
C18—H180.9500C108—C1091.400 (8)
C19—H190.9500C109—C1101.401 (8)
C20—H200.9500C110—C1111.378 (9)
C21—H210.9500C111—C1121.376 (9)
C22—H220.9500C113—C1141.396 (9)
C24—H240.9500C113—C1181.390 (9)
C25—H250.9500C114—C1151.380 (9)
C26—H260.9500C115—C1161.382 (9)
C27—H270.9500C116—C1171.357 (9)
C28—H280.9500C117—C1181.411 (9)
C30—H300.9500C119—C1201.376 (9)
C31—H310.9500C119—C1241.397 (6)
C32—H320.9500C120—C1211.399 (9)
C33—H330.9500C121—C1221.364 (9)
C34—H340.9500C122—C1231.400 (11)
C35—C361.539 (9)C123—C1241.383 (8)
C35—C401.512 (8)C125—C1261.394 (8)
C36—C371.523 (8)C125—C1301.396 (8)
C37—C381.536 (8)C126—C1271.385 (9)
C38—C391.489 (9)C127—C1281.385 (8)
C39—C401.397 (9)C128—C1291.381 (9)
C39—C441.397 (9)C129—C1301.385 (9)
C40—C411.397 (9)C131—C1321.385 (9)
C41—C421.383 (8)C131—C1361.394 (8)
C42—C431.399 (9)C132—C1331.389 (9)
C43—C441.368 (9)C133—C1341.367 (8)
C45—C461.367 (8)C134—C1351.376 (9)
C45—C501.393 (7)C135—C1361.392 (9)
C46—C471.384 (9)C103—H1031.0000
C47—C481.341 (9)C104—H10A0.9900
C48—C491.405 (9)C104—H10B0.9900
C49—C501.384 (8)C105—H10C0.9900
C51—C521.388 (8)C105—H10D0.9900
C51—C561.393 (6)C106—H10E0.9900
C52—C531.396 (9)C106—H10F0.9900
C53—C541.381 (9)C109—H1090.9500
C54—C551.374 (9)C110—H1100.9500
C55—C561.379 (9)C111—H1110.9500
C57—C621.381 (8)C112—H1120.9500
C57—C581.384 (7)C114—H1140.9500
C58—C591.410 (8)C115—H1150.9500
C59—C601.381 (9)C116—H1160.9500
C60—C611.350 (9)C117—H1170.9500
C61—C621.416 (9)C118—H1180.9500
C63—C641.407 (7)C120—H1200.9500
C63—C681.378 (8)C121—H1210.9500
C64—C651.379 (7)C122—H1220.9500
C65—C661.367 (9)C123—H1230.9500
C66—C671.391 (8)C124—H1240.9500
C67—C681.386 (8)C126—H1260.9500
C35—H351.0000C127—H1270.9500
C36—H36A0.9900C128—H1280.9500
C36—H36B0.9900C129—H1290.9500
C37—H37A0.9900C130—H1300.9500
C37—H37B0.9900C132—H1320.9500
C38—H38A0.9900C133—H1330.9500
C38—H38B0.9900C134—H1340.9500
C41—H410.9500C135—H1350.9500
C42—H420.9500C136—H1360.9500
Cl1—Pt1—Cl292.22 (5)C43—C44—H44119.00
Cl1—Pt1—P195.80 (5)C39—C44—H44119.00
Cl1—Pt1—P2168.00 (5)C45—C46—H46120.00
Cl2—Pt1—P1171.79 (6)C47—C46—H46120.00
Cl2—Pt1—P299.71 (5)C46—C47—H47119.00
P1—Pt1—P272.33 (5)C48—C47—H47119.00
P3—Pt2—P472.37 (5)C47—C48—H48120.00
Cl3—Pt2—P4171.03 (5)C49—C48—H48120.00
Cl3—Pt2—Cl491.34 (5)C48—C49—H49120.00
Cl3—Pt2—P398.72 (5)C50—C49—H49120.00
Cl4—Pt2—P3169.94 (5)C45—C50—H50120.00
Cl4—Pt2—P497.57 (5)C49—C50—H50120.00
P5—Pt3—P672.38 (5)C51—C52—H52120.00
Cl5—Pt3—P596.88 (5)C53—C52—H52120.00
Cl5—Pt3—P6169.18 (5)C54—C53—H53120.00
Cl5—Pt3—Cl691.69 (5)C52—C53—H53120.00
Cl6—Pt3—P699.07 (5)C53—C54—H54120.00
Cl6—Pt3—P5171.42 (5)C55—C54—H54120.00
Cl8—Pt4—P899.38 (5)C56—C55—H55119.00
P7—Pt4—P872.14 (5)C54—C55—H55119.00
Cl7—Pt4—Cl891.21 (5)C55—C56—H56120.00
Cl7—Pt4—P797.32 (5)C51—C56—H56120.00
Cl7—Pt4—P8169.36 (5)C57—C58—H58120.00
Cl8—Pt4—P7171.26 (5)C59—C58—H58120.00
C11—P1—C17108.8 (3)C58—C59—H59121.00
N1—P1—C17109.9 (3)C60—C59—H59121.00
Pt1—P1—C11114.52 (19)C61—C60—H60119.00
Pt1—P1—N194.20 (14)C59—C60—H60119.00
N1—P1—C11110.2 (2)C62—C61—H61120.00
Pt1—P1—C17118.2 (2)C60—C61—H61120.00
Pt1—P2—C29118.2 (2)C61—C62—H62121.00
Pt1—P2—N194.14 (14)C57—C62—H62120.00
C23—P2—C29109.4 (3)C65—C64—H64120.00
N1—P2—C29106.7 (2)C63—C64—H64120.00
Pt1—P2—C23117.4 (2)C64—C65—H65120.00
N1—P2—C23109.1 (2)C66—C65—H65120.00
Pt2—P3—C45117.23 (17)C65—C66—H66120.00
N2—P3—C45109.5 (2)C67—C66—H66120.00
Pt2—P3—N293.75 (12)C66—C67—H67120.00
N2—P3—C51110.6 (2)C68—C67—H67120.00
C45—P3—C51109.3 (2)C67—C68—H68120.00
Pt2—P3—C51115.27 (16)C63—C68—H68120.00
Pt2—P4—N294.58 (14)N3—C69—C70110.3 (5)
Pt2—P4—C57115.7 (2)N3—C69—C74112.1 (5)
C57—P4—C63108.7 (2)C70—C69—C74113.2 (4)
Pt2—P4—C63119.44 (19)C69—C70—C71109.9 (5)
N2—P4—C57109.5 (2)C70—C71—C72107.7 (5)
N2—P4—C63107.4 (2)C71—C72—C73113.1 (4)
Pt3—P5—C79114.54 (16)C72—C73—C78120.2 (5)
Pt3—P5—C85118.73 (19)C72—C73—C74123.7 (5)
Pt3—P5—N393.92 (12)C74—C73—C78116.1 (6)
N3—P5—C85109.8 (2)C73—C74—C75120.8 (6)
N3—P5—C79111.7 (2)C69—C74—C73119.4 (5)
C79—P5—C85107.5 (2)C69—C74—C75119.8 (5)
Pt3—P6—N393.62 (14)C74—C75—C76121.0 (6)
C91—P6—C97108.6 (3)C75—C76—C77119.3 (7)
Pt3—P6—C97118.4 (2)C76—C77—C78119.9 (8)
N3—P6—C97108.6 (2)C73—C78—C77122.9 (6)
Pt3—P6—C91116.4 (2)C80—C79—C84119.6 (6)
N3—P6—C91109.9 (2)P5—C79—C80118.4 (4)
N4—P7—C113109.8 (3)P5—C79—C84121.7 (4)
Pt4—P7—C119118.21 (19)C79—C80—C81120.7 (6)
C113—P7—C119108.4 (3)C80—C81—C82118.7 (6)
Pt4—P7—C113115.4 (2)C81—C82—C83121.8 (6)
Pt4—P7—N493.64 (13)C82—C83—C84119.9 (6)
N4—P7—C119110.4 (2)C79—C84—C83119.4 (6)
C125—P8—C131107.6 (3)C86—C85—C90119.4 (5)
Pt4—P8—C125116.0 (2)P5—C85—C90121.5 (5)
Pt4—P8—N493.45 (14)P5—C85—C86118.9 (4)
N4—P8—C125109.3 (2)C85—C86—C87120.4 (5)
Pt4—P8—C131119.1 (2)C86—C87—C88119.5 (6)
N4—P8—C131110.4 (2)C87—C88—C89120.7 (6)
P1—N1—C1133.0 (3)C88—C89—C90120.3 (6)
P2—N1—C1127.6 (3)C85—C90—C89119.8 (6)
P1—N1—P299.3 (2)P6—C91—C96116.6 (4)
P4—N2—C35125.9 (3)C92—C91—C96118.5 (5)
P3—N2—C35134.8 (3)P6—C91—C92124.9 (4)
P3—N2—P499.09 (19)C91—C92—C93119.9 (5)
P6—N3—C69128.9 (3)C92—C93—C94121.7 (6)
P5—N3—P699.49 (19)C93—C94—C95118.8 (6)
P5—N3—C69131.6 (3)C94—C95—C96121.2 (6)
P8—N4—C103128.8 (3)C91—C96—C95119.9 (5)
P7—N4—P899.9 (2)C98—C97—C102119.6 (5)
P7—N4—C103131.3 (3)P6—C97—C98116.5 (4)
N1—C1—C2110.6 (5)P6—C97—C102123.9 (4)
C2—C1—C6114.4 (4)C97—C98—C99120.7 (5)
N1—C1—C6112.3 (5)C98—C99—C100119.7 (6)
C1—C2—C3110.3 (5)C99—C100—C101119.7 (6)
C2—C3—C4108.4 (5)C100—C101—C102120.8 (6)
C3—C4—C5112.6 (5)C97—C102—C101119.5 (6)
C4—C5—C6121.9 (6)C74—C69—H69107.00
C4—C5—C10119.6 (5)N3—C69—H69107.00
C6—C5—C10118.5 (6)C70—C69—H69107.00
C1—C6—C5120.0 (5)H70A—C70—H70B108.00
C5—C6—C7119.7 (6)C69—C70—H70A110.00
C1—C6—C7120.3 (5)C69—C70—H70B110.00
C6—C7—C8121.0 (6)C71—C70—H70A110.00
C7—C8—C9119.6 (6)C71—C70—H70B110.00
C8—C9—C10119.9 (6)C70—C71—H71B110.00
C5—C10—C9121.1 (6)C72—C71—H71A110.00
C12—C11—C16119.3 (5)C70—C71—H71A110.00
P1—C11—C16122.9 (5)C72—C71—H71B110.00
P1—C11—C12117.5 (4)H71A—C71—H71B109.00
C11—C12—C13118.9 (5)H72A—C72—H72B108.00
C12—C13—C14121.5 (6)C73—C72—H72A109.00
C13—C14—C15119.3 (6)C73—C72—H72B109.00
C14—C15—C16120.6 (6)C71—C72—H72A109.00
C11—C16—C15120.3 (6)C71—C72—H72B109.00
P1—C17—C18117.9 (5)C74—C75—H75119.00
C18—C17—C22120.4 (6)C76—C75—H75120.00
P1—C17—C22121.4 (5)C77—C76—H76120.00
C17—C18—C19120.5 (6)C75—C76—H76120.00
C18—C19—C20120.0 (6)C76—C77—H77120.00
C19—C20—C21119.7 (6)C78—C77—H77120.00
C20—C21—C22120.7 (6)C73—C78—H78119.00
C17—C22—C21118.8 (6)C77—C78—H78119.00
P2—C23—C28123.3 (5)C81—C80—H80120.00
C24—C23—C28118.6 (6)C79—C80—H80120.00
P2—C23—C24118.1 (4)C80—C81—H81121.00
C23—C24—C25121.1 (6)C82—C81—H81121.00
C24—C25—C26120.4 (6)C81—C82—H82119.00
C25—C26—C27120.6 (6)C83—C82—H82119.00
C26—C27—C28120.0 (7)C84—C83—H83120.00
C23—C28—C27119.3 (6)C82—C83—H83120.00
C30—C29—C34120.1 (5)C79—C84—H84120.00
P2—C29—C30123.4 (5)C83—C84—H84120.00
P2—C29—C34116.4 (4)C85—C86—H86120.00
C29—C30—C31119.9 (6)C87—C86—H86120.00
C30—C31—C32120.1 (6)C88—C87—H87120.00
C31—C32—C33121.1 (6)C86—C87—H87120.00
C32—C33—C34118.6 (6)C89—C88—H88120.00
C29—C34—C33120.2 (5)C87—C88—H88120.00
N1—C1—H1106.00C88—C89—H89120.00
C2—C1—H1106.00C90—C89—H89120.00
C6—C1—H1106.00C85—C90—H90120.00
H2A—C2—H2B108.00C89—C90—H90120.00
C1—C2—H2A110.00C93—C92—H92120.00
C1—C2—H2B110.00C91—C92—H92120.00
C3—C2—H2B110.00C94—C93—H93119.00
C3—C2—H2A110.00C92—C93—H93119.00
C2—C3—H3A110.00C93—C94—H94121.00
C4—C3—H3A110.00C95—C94—H94121.00
C4—C3—H3B110.00C94—C95—H95119.00
C2—C3—H3B110.00C96—C95—H95119.00
H3A—C3—H3B108.00C91—C96—H96120.00
C5—C4—H4B109.00C95—C96—H96120.00
C3—C4—H4A109.00C97—C98—H98120.00
C3—C4—H4B109.00C99—C98—H98120.00
C5—C4—H4A109.00C98—C99—H99120.00
H4A—C4—H4B108.00C100—C99—H99120.00
C8—C7—H7119.00C101—C100—H100120.00
C6—C7—H7120.00C99—C100—H100120.00
C9—C8—H8120.00C100—C101—H101120.00
C7—C8—H8120.00C102—C101—H101120.00
C8—C9—H9120.00C101—C102—H102120.00
C10—C9—H9120.00C97—C102—H102120.00
C5—C10—H10120.00N4—C103—C104111.0 (4)
C9—C10—H10119.00N4—C103—C108111.4 (4)
C13—C12—H12120.00C104—C103—C108112.9 (4)
C11—C12—H12121.00C103—C104—C105109.5 (5)
C12—C13—H13119.00C104—C105—C106110.0 (5)
C14—C13—H13119.00C105—C106—C107112.7 (4)
C15—C14—H14120.00C106—C107—C108121.7 (5)
C13—C14—H14120.00C106—C107—C112120.1 (5)
C16—C15—H15120.00C108—C107—C112118.3 (6)
C14—C15—H15120.00C103—C108—C107120.7 (5)
C11—C16—H16120.00C103—C108—C109119.8 (4)
C15—C16—H16120.00C107—C108—C109119.4 (5)
C19—C18—H18120.00C108—C109—C110120.7 (5)
C17—C18—H18120.00C109—C110—C111119.6 (5)
C20—C19—H19120.00C110—C111—C112119.9 (6)
C18—C19—H19120.00C107—C112—C111122.1 (6)
C21—C20—H20120.00P7—C113—C114118.1 (5)
C19—C20—H20120.00P7—C113—C118122.7 (5)
C20—C21—H21120.00C114—C113—C118118.8 (6)
C22—C21—H21120.00C113—C114—C115120.6 (6)
C17—C22—H22121.00C114—C115—C116119.9 (6)
C21—C22—H22121.00C115—C116—C117121.0 (6)
C25—C24—H24119.00C116—C117—C118119.8 (6)
C23—C24—H24119.00C113—C118—C117120.0 (6)
C24—C25—H25120.00P7—C119—C120118.5 (4)
C26—C25—H25120.00P7—C119—C124121.3 (5)
C27—C26—H26120.00C120—C119—C124120.1 (5)
C25—C26—H26120.00C119—C120—C121119.5 (6)
C26—C27—H27120.00C120—C121—C122121.0 (7)
C28—C27—H27120.00C121—C122—C123119.6 (6)
C27—C28—H28120.00C122—C123—C124120.0 (6)
C23—C28—H28120.00C119—C124—C123119.9 (6)
C31—C30—H30120.00P8—C125—C126116.6 (4)
C29—C30—H30120.00P8—C125—C130124.3 (4)
C32—C31—H31120.00C126—C125—C130119.1 (5)
C30—C31—H31120.00C125—C126—C127120.7 (5)
C31—C32—H32119.00C126—C127—C128119.7 (6)
C33—C32—H32120.00C127—C128—C129120.0 (6)
C34—C33—H33121.00C128—C129—C130120.6 (5)
C32—C33—H33121.00C125—C130—C129119.8 (5)
C29—C34—H34120.00P8—C131—C132118.7 (4)
C33—C34—H34120.00P8—C131—C136121.9 (5)
C36—C35—C40114.7 (4)C132—C131—C136119.4 (6)
N2—C35—C36110.5 (4)C131—C132—C133120.4 (5)
N2—C35—C40113.2 (4)C132—C133—C134120.4 (6)
C35—C36—C37110.9 (5)C133—C134—C135119.7 (6)
C36—C37—C38109.5 (5)C134—C135—C136121.1 (7)
C37—C38—C39111.7 (4)C131—C136—C135119.1 (6)
C38—C39—C40121.5 (5)N4—C103—H103107.00
C40—C39—C44117.8 (6)C104—C103—H103107.00
C38—C39—C44120.5 (5)C108—C103—H103107.00
C39—C40—C41119.9 (6)C103—C104—H10A110.00
C35—C40—C39121.9 (5)C103—C104—H10B110.00
C35—C40—C41118.2 (5)C105—C104—H10A110.00
C40—C41—C42121.3 (6)C105—C104—H10B110.00
C41—C42—C43118.6 (5)H10A—C104—H10B108.00
C42—C43—C44120.1 (6)C104—C105—H10C110.00
C39—C44—C43122.2 (6)C104—C105—H10D110.00
P3—C45—C46118.2 (4)C106—C105—H10C110.00
P3—C45—C50122.5 (4)C106—C105—H10D110.00
C46—C45—C50119.2 (5)H10C—C105—H10D108.00
C45—C46—C47120.5 (5)C105—C106—H10E109.00
C46—C47—C48121.3 (6)C105—C106—H10F109.00
C47—C48—C49119.4 (6)C107—C106—H10E109.00
C48—C49—C50119.7 (5)C107—C106—H10F109.00
C45—C50—C49120.0 (5)H10E—C106—H10F108.00
P3—C51—C56124.5 (4)C108—C109—H109120.00
P3—C51—C52115.9 (4)C110—C109—H109120.00
C52—C51—C56119.6 (6)C109—C110—H110120.00
C51—C52—C53119.9 (6)C111—C110—H110120.00
C52—C53—C54120.2 (6)C110—C111—H111120.00
C53—C54—C55119.2 (6)C112—C111—H111120.00
C54—C55—C56121.7 (5)C107—C112—H112119.00
C51—C56—C55119.4 (5)C111—C112—H112119.00
P4—C57—C62122.5 (4)C113—C114—H114120.00
P4—C57—C58117.2 (4)C115—C114—H114120.00
C58—C57—C62120.0 (5)C114—C115—H115120.00
C57—C58—C59120.3 (5)C116—C115—H115120.00
C58—C59—C60118.7 (6)C115—C116—H116119.00
C59—C60—C61121.4 (6)C117—C116—H116120.00
C60—C61—C62120.5 (6)C116—C117—H117120.00
C57—C62—C61119.1 (5)C118—C117—H117120.00
P4—C63—C64121.9 (4)C113—C118—H118120.00
C64—C63—C68118.5 (5)C117—C118—H118120.00
P4—C63—C68119.3 (4)C119—C120—H120120.00
C63—C64—C65120.5 (5)C121—C120—H120120.00
C64—C65—C66120.2 (5)C120—C121—H121120.00
C65—C66—C67120.3 (6)C122—C121—H121119.00
C66—C67—C68119.7 (6)C121—C122—H122120.00
C63—C68—C67120.9 (5)C123—C122—H122120.00
C40—C35—H35106.00C122—C123—H123120.00
C36—C35—H35106.00C124—C123—H123120.00
N2—C35—H35106.00C119—C124—H124120.00
C35—C36—H36B110.00C123—C124—H124120.00
C35—C36—H36A109.00C125—C126—H126120.00
H36A—C36—H36B108.00C127—C126—H126120.00
C37—C36—H36A110.00C126—C127—H127120.00
C37—C36—H36B109.00C128—C127—H127120.00
C38—C37—H37A110.00C127—C128—H128120.00
C36—C37—H37A110.00C129—C128—H128120.00
C36—C37—H37B110.00C128—C129—H129120.00
C38—C37—H37B110.00C130—C129—H129120.00
H37A—C37—H37B108.00C125—C130—H130120.00
C37—C38—H38B109.00C129—C130—H130120.00
C39—C38—H38A109.00C131—C132—H132120.00
C39—C38—H38B109.00C133—C132—H132120.00
H38A—C38—H38B108.00C132—C133—H133120.00
C37—C38—H38A109.00C134—C133—H133120.00
C40—C41—H41119.00C133—C134—H134120.00
C42—C41—H41119.00C135—C134—H134120.00
C43—C42—H42121.00C134—C135—H135120.00
C41—C42—H42121.00C136—C135—H135119.00
C44—C43—H43120.00C131—C136—H136120.00
C42—C43—H43120.00C135—C136—H136121.00
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
C15—H15···Cl4i0.952.723.635 (6)162
C24—H24···Cl20.952.783.626 (6)149
C38—H38B···Cl6ii0.992.783.624 (5)144
C54—H54···Cl6iii0.952.833.573 (6)136
C59—H59···Cl6iv0.952.783.518 (6)136
C92—H92···Cl10.952.773.658 (6)155
C116—H116···Cl20.952.803.689 (7)156
C130—H130···Cl3iii0.952.823.706 (6)155
Symmetry codes: (i) x, y, z1; (ii) x1, y, z; (iii) x+1, y+1/2, z+1; (iv) x+1, y1/2, z+1.
 

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