Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806001826/wk6073sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536806001826/wk6073Isup2.hkl |
CCDC reference: 298563
Key indicators
- Single-crystal X-ray study
- T = 303 K
- Mean (C-C) = 0.018 Å
- Disorder in solvent or counterion
- R factor = 0.065
- wR factor = 0.180
- Data-to-parameter ratio = 17.1
checkCIF/PLATON results
No syntax errors found
Alert level B PLAT220_ALERT_2_B Large Non-Solvent C Ueq(max)/Ueq(min) ... 4.09 Ratio
Alert level C PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT125_ALERT_4_C No _symmetry_space_group_name_Hall Given ....... ? PLAT150_ALERT_1_C Volume as Calculated Differs from that Given ... 5586.00 Ang-3 PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 3.04 Ratio PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C5 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C10 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C16 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C7 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for Cl2 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C55 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C56 PLAT302_ALERT_4_C Anion/Solvent Disorder ......................... 47.00 Perc. PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 18 PLAT779_ALERT_2_C Suspect or Irrelevant (Bond) Angle in CIF ...... 26.90 Deg. O4' -CL2 -O4 1.555 1.555 1.555 PLAT779_ALERT_2_C Suspect or Irrelevant (Bond) Angle in CIF ...... 41.00 Deg. O1 -CL2 -O3' 1.555 1.555 1.555
0 ALERT level A = In general: serious problem 1 ALERT level B = Potentially serious problem 15 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 7 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 5 ALERT type 4 Improvement, methodology, query or suggestion
Data collection: SMART (Bruker, 1998); cell refinement: SMART (Bruker, 1998); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 1998); software used to prepare material for publication: SHELXTL.
[PtCl(C18H15P)3](ClO4)·2CH2Cl2 | F(000) = 2400 |
Mr = 1201.73 | Dx = 1.429 Mg m−3 |
Monoclinic, P21/c | Mo Kα radiation, λ = 0.71073 Å |
a = 17.889 (5) Å | Cell parameters from 992 reflections |
b = 12.323 (3) Å | θ = 2.9–24.7° |
c = 26.217 (9) Å | µ = 2.83 mm−1 |
β = 104.848 (12)° | T = 303 K |
V = 5586 (3) Å3 | Block, colorless |
Z = 4 | 0.24 × 0.20 × 0.10 mm |
Bruker SMART APEX-II CCD area-detector diffractometer | 11417 independent reflections |
Radiation source: fine-focus sealed tube | 7366 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.072 |
φ and ω scans | θmax = 26.5°, θmin = 1.2° |
Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | h = −22→20 |
Tmin = 0.493, Tmax = 0.753 | k = −15→15 |
28838 measured reflections | l = −32→26 |
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)] = 0.065 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.180 | H-atom parameters constrained |
S = 1.09 | w = 1/[σ2(Fo2) + (0.0887P)2] where P = (Fo2 + 2Fc2)/3 |
11417 reflections | (Δ/σ)max = 0.006 |
669 parameters | Δρmax = 1.46 e Å−3 |
164 restraints | Δρmin = −1.03 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 | Occ. (<1) | |
Pt1 | 0.705751 (18) | 0.70379 (3) | 0.384905 (15) | 0.03302 (13) | |
Cl1 | 0.58334 (13) | 0.7618 (2) | 0.33447 (12) | 0.0575 (8) | |
P1 | 0.75095 (13) | 0.85494 (19) | 0.34633 (11) | 0.0364 (6) | |
P2 | 0.63154 (12) | 0.59179 (19) | 0.42660 (10) | 0.0337 (5) | |
P3 | 0.82088 (12) | 0.62386 (18) | 0.42224 (10) | 0.0305 (5) | |
C1 | 0.7541 (5) | 0.8281 (8) | 0.2796 (4) | 0.043 (2) | |
C2 | 0.7342 (6) | 0.7259 (9) | 0.2591 (5) | 0.055 (3) | |
H2 | 0.7180 | 0.6726 | 0.2789 | 0.066* | |
C3 | 0.7392 (7) | 0.7042 (12) | 0.2067 (5) | 0.076 (4) | |
H3 | 0.7263 | 0.6353 | 0.1928 | 0.091* | |
C4 | 0.7618 (8) | 0.7793 (15) | 0.1763 (6) | 0.088 (5) | |
H4 | 0.7640 | 0.7638 | 0.1420 | 0.105* | |
C5 | 0.7810 (8) | 0.8779 (15) | 0.1980 (7) | 0.094 (5) | |
H5 | 0.7985 | 0.9303 | 0.1782 | 0.113* | |
C6 | 0.7760 (6) | 0.9046 (10) | 0.2480 (5) | 0.062 (3) | |
H6 | 0.7874 | 0.9748 | 0.2606 | 0.075* | |
C7 | 0.6854 (5) | 0.9681 (8) | 0.3461 (5) | 0.046 (3) | |
C8 | 0.6568 (6) | 1.0307 (9) | 0.3025 (6) | 0.064 (3) | |
H8 | 0.6682 | 1.0138 | 0.2708 | 0.077* | |
C9 | 0.6095 (9) | 1.1217 (12) | 0.3060 (9) | 0.103 (6) | |
H9 | 0.5875 | 1.1636 | 0.2764 | 0.124* | |
C10 | 0.5976 (11) | 1.1454 (15) | 0.3539 (11) | 0.132 (9) | |
H10 | 0.5681 | 1.2063 | 0.3564 | 0.158* | |
C11 | 0.6257 (11) | 1.0866 (15) | 0.3979 (9) | 0.126 (7) | |
H11 | 0.6165 | 1.1071 | 0.4299 | 0.152* | |
C12 | 0.6684 (8) | 0.9954 (11) | 0.3942 (6) | 0.090 (5) | |
H12 | 0.6862 | 0.9515 | 0.4237 | 0.108* | |
C13 | 0.8435 (5) | 0.9194 (7) | 0.3777 (4) | 0.040 (2) | |
C14 | 0.9026 (6) | 0.9274 (9) | 0.3545 (5) | 0.060 (3) | |
H14 | 0.8975 | 0.8921 | 0.3224 | 0.072* | |
C15 | 0.9702 (8) | 0.9844 (12) | 0.3752 (7) | 0.081 (4) | |
H15 | 1.0097 | 0.9876 | 0.3580 | 0.097* | |
C16 | 0.9757 (10) | 1.0349 (12) | 0.4214 (9) | 0.113 (8) | |
H16 | 1.0193 | 1.0768 | 0.4357 | 0.136* | |
C17 | 0.9186 (9) | 1.0269 (10) | 0.4488 (7) | 0.089 (5) | |
H17 | 0.9248 | 1.0604 | 0.4815 | 0.106* | |
C18 | 0.8520 (7) | 0.9676 (9) | 0.4263 (5) | 0.063 (3) | |
H18 | 0.8133 | 0.9606 | 0.4439 | 0.075* | |
C19 | 0.5785 (5) | 0.6891 (7) | 0.4551 (4) | 0.040 (2) | |
C20 | 0.6198 (6) | 0.7733 (9) | 0.4868 (5) | 0.057 (3) | |
H20 | 0.6732 | 0.7772 | 0.4924 | 0.069* | |
C21 | 0.5830 (7) | 0.8481 (10) | 0.5092 (6) | 0.075 (4) | |
H21 | 0.6117 | 0.9019 | 0.5303 | 0.090* | |
C22 | 0.5024 (8) | 0.8466 (9) | 0.5013 (6) | 0.079 (4) | |
H22 | 0.4776 | 0.8999 | 0.5160 | 0.095* | |
C23 | 0.4601 (6) | 0.7636 (10) | 0.4709 (6) | 0.068 (4) | |
H23 | 0.4067 | 0.7603 | 0.4655 | 0.082* | |
C24 | 0.4986 (6) | 0.6853 (9) | 0.4485 (5) | 0.054 (3) | |
H24 | 0.4703 | 0.6294 | 0.4287 | 0.065* | |
C25 | 0.5624 (4) | 0.5007 (7) | 0.3847 (4) | 0.032 (2) | |
C26 | 0.5511 (5) | 0.4954 (9) | 0.3309 (4) | 0.050 (3) | |
H26 | 0.5799 | 0.5406 | 0.3149 | 0.060* | |
C27 | 0.4980 (6) | 0.4248 (11) | 0.2995 (5) | 0.066 (3) | |
H27 | 0.4934 | 0.4196 | 0.2634 | 0.079* | |
C28 | 0.4528 (7) | 0.3634 (10) | 0.3233 (6) | 0.076 (4) | |
H28 | 0.4157 | 0.3180 | 0.3025 | 0.091* | |
C29 | 0.4604 (6) | 0.3662 (9) | 0.3773 (6) | 0.066 (4) | |
H29 | 0.4294 | 0.3237 | 0.3929 | 0.079* | |
C30 | 0.5168 (5) | 0.4359 (8) | 0.4074 (5) | 0.052 (3) | |
H30 | 0.5236 | 0.4386 | 0.4438 | 0.063* | |
C31 | 0.6754 (5) | 0.5016 (7) | 0.4815 (4) | 0.037 (2) | |
C32 | 0.6820 (6) | 0.5292 (10) | 0.5334 (5) | 0.058 (3) | |
H32 | 0.6656 | 0.5974 | 0.5412 | 0.070* | |
C33 | 0.7128 (8) | 0.4573 (12) | 0.5747 (5) | 0.077 (4) | |
H33 | 0.7167 | 0.4769 | 0.6095 | 0.092* | |
C34 | 0.7376 (7) | 0.3561 (12) | 0.5626 (6) | 0.076 (4) | |
H34 | 0.7585 | 0.3077 | 0.5898 | 0.092* | |
C35 | 0.7319 (6) | 0.3257 (9) | 0.5111 (5) | 0.056 (3) | |
H35 | 0.7484 | 0.2576 | 0.5033 | 0.067* | |
C36 | 0.7007 (5) | 0.4001 (8) | 0.4709 (4) | 0.049 (3) | |
H36 | 0.6969 | 0.3807 | 0.4361 | 0.059* | |
C37 | 0.8484 (4) | 0.6283 (7) | 0.4938 (4) | 0.033 (2) | |
C38 | 0.8437 (6) | 0.7263 (8) | 0.5163 (4) | 0.050 (3) | |
H38 | 0.8224 | 0.7848 | 0.4951 | 0.059* | |
C39 | 0.8703 (6) | 0.7407 (10) | 0.5708 (5) | 0.057 (3) | |
H39 | 0.8662 | 0.8083 | 0.5856 | 0.068* | |
C40 | 0.9019 (6) | 0.6566 (11) | 0.6022 (5) | 0.064 (3) | |
H40 | 0.9209 | 0.6663 | 0.6384 | 0.076* | |
C41 | 0.9057 (6) | 0.5546 (11) | 0.5793 (5) | 0.066 (3) | |
H41 | 0.9272 | 0.4960 | 0.6004 | 0.079* | |
C42 | 0.8782 (5) | 0.5412 (8) | 0.5267 (4) | 0.047 (3) | |
H42 | 0.8792 | 0.4726 | 0.5121 | 0.057* | |
C43 | 0.8208 (5) | 0.4837 (7) | 0.4000 (4) | 0.038 (2) | |
C44 | 0.7594 (6) | 0.4419 (8) | 0.3607 (4) | 0.049 (3) | |
H44 | 0.7172 | 0.4857 | 0.3457 | 0.059* | |
C45 | 0.7612 (8) | 0.3335 (10) | 0.3437 (5) | 0.071 (4) | |
H45 | 0.7197 | 0.3050 | 0.3183 | 0.085* | |
C46 | 0.8249 (9) | 0.2703 (9) | 0.3650 (6) | 0.078 (4) | |
H46 | 0.8255 | 0.1981 | 0.3548 | 0.094* | |
C47 | 0.8875 (8) | 0.3121 (9) | 0.4011 (6) | 0.073 (4) | |
H47 | 0.9305 | 0.2685 | 0.4145 | 0.088* | |
C48 | 0.8876 (6) | 0.4180 (8) | 0.4178 (5) | 0.050 (3) | |
H48 | 0.9315 | 0.4467 | 0.4408 | 0.060* | |
C49 | 0.9077 (5) | 0.6728 (7) | 0.4051 (4) | 0.035 (2) | |
C50 | 0.9137 (5) | 0.6541 (8) | 0.3536 (4) | 0.046 (3) | |
H50 | 0.8727 | 0.6218 | 0.3292 | 0.055* | |
C51 | 0.9787 (6) | 0.6825 (9) | 0.3386 (5) | 0.060 (3) | |
H51 | 0.9812 | 0.6717 | 0.3040 | 0.072* | |
C52 | 1.0406 (6) | 0.7272 (10) | 0.3749 (6) | 0.064 (4) | |
H52 | 1.0850 | 0.7464 | 0.3648 | 0.077* | |
C53 | 1.0370 (6) | 0.7433 (10) | 0.4253 (6) | 0.066 (4) | |
H53 | 1.0791 | 0.7731 | 0.4497 | 0.080* | |
C54 | 0.9703 (5) | 0.7153 (8) | 0.4410 (4) | 0.044 (2) | |
H54 | 0.9685 | 0.7256 | 0.4758 | 0.052* | |
Cl2 | 0.76737 (18) | 0.0282 (2) | 0.57483 (15) | 0.0695 (9) | |
O1 | 0.7460 (12) | −0.0716 (13) | 0.5943 (11) | 0.114 (11) | 0.52 (3) |
O2 | 0.816 (2) | 0.010 (3) | 0.5403 (13) | 0.224 (17) | 0.52 (3) |
O3 | 0.807 (2) | 0.0960 (19) | 0.6175 (9) | 0.209 (16) | 0.52 (3) |
O4 | 0.6988 (10) | 0.0832 (18) | 0.5458 (12) | 0.148 (14) | 0.52 (3) |
O1' | 0.7613 (15) | −0.044 (2) | 0.5317 (8) | 0.130 (13) | 0.48 (3) |
O2' | 0.8273 (11) | 0.1048 (16) | 0.5780 (15) | 0.148 (14) | 0.48 (3) |
O3' | 0.785 (2) | −0.034 (2) | 0.6229 (8) | 0.186 (15) | 0.48 (3) |
O4' | 0.6955 (10) | 0.083 (2) | 0.5705 (13) | 0.170 (17) | 0.48 (3) |
C55 | 0.8553 (9) | 0.3530 (12) | 0.2323 (13) | 0.135 (12) | 0.603 (6) |
H55A | 0.8342 | 0.3742 | 0.1958 | 0.162* | 0.603 (6) |
H55B | 0.8204 | 0.3786 | 0.2526 | 0.162* | 0.603 (6) |
Cl3 | 0.9441 (8) | 0.4112 (10) | 0.2558 (5) | 0.218 (6) | 0.603 (6) |
Cl4 | 0.8623 (9) | 0.2141 (10) | 0.2365 (6) | 0.228 (6) | 0.603 (6) |
C56 | 0.6101 (16) | 0.3532 (16) | 0.1610 (7) | 0.088 (10) | 0.397 (6) |
H56A | 0.6309 | 0.3805 | 0.1328 | 0.105* | 0.397 (6) |
H56B | 0.5554 | 0.3388 | 0.1466 | 0.105* | 0.397 (6) |
Cl5 | 0.6214 (8) | 0.4485 (11) | 0.2094 (6) | 0.149 (5) | 0.397 (6) |
Cl6 | 0.6566 (11) | 0.2346 (12) | 0.1853 (8) | 0.199 (8) | 0.397 (6) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Pt1 | 0.02707 (18) | 0.0332 (2) | 0.0401 (2) | 0.00237 (16) | 0.01106 (13) | 0.00559 (19) |
Cl1 | 0.0277 (12) | 0.0618 (17) | 0.080 (2) | 0.0082 (11) | 0.0077 (12) | 0.0288 (15) |
P1 | 0.0347 (12) | 0.0296 (13) | 0.0467 (16) | 0.0026 (10) | 0.0136 (11) | 0.0039 (11) |
P2 | 0.0254 (11) | 0.0348 (13) | 0.0418 (15) | −0.0041 (9) | 0.0104 (10) | 0.0035 (11) |
P3 | 0.0232 (11) | 0.0267 (12) | 0.0445 (15) | 0.0013 (9) | 0.0137 (10) | 0.0028 (10) |
C1 | 0.041 (5) | 0.043 (6) | 0.046 (6) | 0.001 (4) | 0.013 (5) | 0.009 (5) |
C2 | 0.058 (7) | 0.061 (8) | 0.050 (7) | 0.010 (5) | 0.019 (5) | 0.003 (6) |
C3 | 0.078 (9) | 0.090 (10) | 0.062 (9) | −0.001 (7) | 0.020 (7) | −0.026 (8) |
C4 | 0.083 (10) | 0.127 (15) | 0.058 (9) | 0.005 (10) | 0.026 (7) | 0.029 (10) |
C5 | 0.096 (11) | 0.103 (13) | 0.096 (13) | 0.009 (10) | 0.050 (9) | 0.034 (11) |
C6 | 0.069 (8) | 0.071 (8) | 0.055 (8) | 0.001 (6) | 0.030 (6) | 0.013 (7) |
C7 | 0.043 (6) | 0.032 (5) | 0.065 (8) | −0.006 (4) | 0.019 (5) | 0.002 (5) |
C8 | 0.048 (6) | 0.049 (7) | 0.094 (10) | 0.004 (5) | 0.016 (6) | 0.015 (7) |
C9 | 0.096 (12) | 0.058 (10) | 0.152 (18) | 0.016 (8) | 0.025 (11) | 0.031 (11) |
C10 | 0.106 (14) | 0.071 (12) | 0.23 (3) | 0.040 (10) | 0.069 (17) | 0.009 (16) |
C11 | 0.125 (15) | 0.105 (15) | 0.17 (2) | 0.030 (12) | 0.082 (15) | −0.020 (14) |
C12 | 0.092 (10) | 0.086 (10) | 0.104 (12) | 0.049 (8) | 0.047 (9) | −0.009 (9) |
C13 | 0.034 (5) | 0.025 (5) | 0.057 (7) | −0.001 (4) | 0.004 (5) | 0.004 (5) |
C14 | 0.037 (6) | 0.053 (7) | 0.085 (9) | −0.009 (5) | 0.007 (6) | 0.016 (6) |
C15 | 0.065 (9) | 0.079 (11) | 0.099 (13) | −0.010 (7) | 0.021 (8) | 0.024 (9) |
C16 | 0.083 (11) | 0.047 (9) | 0.18 (2) | −0.017 (8) | −0.012 (13) | 0.048 (11) |
C17 | 0.098 (11) | 0.046 (8) | 0.098 (12) | −0.001 (8) | −0.020 (9) | −0.014 (8) |
C18 | 0.063 (7) | 0.049 (7) | 0.080 (10) | −0.007 (6) | 0.026 (7) | 0.004 (7) |
C19 | 0.035 (5) | 0.034 (5) | 0.054 (6) | −0.003 (4) | 0.013 (4) | 0.002 (5) |
C20 | 0.054 (7) | 0.057 (7) | 0.071 (8) | −0.011 (5) | 0.033 (6) | −0.019 (6) |
C21 | 0.066 (8) | 0.064 (8) | 0.107 (12) | −0.013 (6) | 0.043 (8) | −0.029 (8) |
C22 | 0.101 (10) | 0.037 (7) | 0.120 (13) | −0.001 (7) | 0.065 (9) | −0.018 (8) |
C23 | 0.037 (6) | 0.068 (8) | 0.108 (11) | 0.016 (5) | 0.035 (6) | −0.006 (8) |
C24 | 0.036 (5) | 0.056 (7) | 0.076 (8) | −0.008 (5) | 0.023 (5) | −0.011 (6) |
C25 | 0.019 (4) | 0.030 (5) | 0.045 (6) | 0.000 (3) | 0.002 (4) | −0.004 (4) |
C26 | 0.034 (5) | 0.055 (7) | 0.052 (7) | −0.005 (5) | −0.004 (5) | −0.006 (5) |
C27 | 0.053 (7) | 0.085 (9) | 0.053 (8) | 0.005 (6) | 0.003 (6) | −0.005 (7) |
C28 | 0.061 (8) | 0.056 (8) | 0.091 (12) | 0.001 (6) | −0.014 (7) | −0.010 (8) |
C29 | 0.041 (6) | 0.044 (7) | 0.110 (12) | −0.002 (5) | 0.014 (7) | 0.010 (7) |
C30 | 0.043 (6) | 0.049 (6) | 0.063 (8) | −0.004 (5) | 0.009 (5) | −0.002 (6) |
C31 | 0.033 (5) | 0.035 (5) | 0.046 (6) | 0.003 (4) | 0.018 (4) | 0.005 (5) |
C32 | 0.061 (7) | 0.058 (7) | 0.055 (8) | −0.008 (6) | 0.014 (6) | −0.005 (6) |
C33 | 0.095 (10) | 0.082 (10) | 0.043 (8) | −0.006 (8) | −0.003 (7) | 0.015 (7) |
C34 | 0.073 (9) | 0.082 (10) | 0.066 (10) | −0.004 (7) | 0.002 (7) | 0.032 (8) |
C35 | 0.041 (6) | 0.043 (6) | 0.083 (10) | 0.008 (5) | 0.014 (6) | 0.027 (6) |
C36 | 0.045 (6) | 0.053 (7) | 0.052 (7) | −0.015 (5) | 0.016 (5) | 0.004 (5) |
C37 | 0.026 (4) | 0.031 (5) | 0.039 (5) | −0.003 (4) | 0.006 (4) | 0.004 (4) |
C38 | 0.057 (6) | 0.042 (7) | 0.054 (7) | 0.001 (5) | 0.022 (5) | −0.001 (5) |
C39 | 0.055 (7) | 0.050 (7) | 0.066 (8) | 0.003 (5) | 0.018 (6) | −0.015 (6) |
C40 | 0.056 (7) | 0.083 (9) | 0.048 (7) | 0.001 (6) | 0.006 (6) | 0.002 (7) |
C41 | 0.065 (8) | 0.070 (9) | 0.054 (8) | 0.009 (6) | 0.001 (6) | 0.024 (7) |
C42 | 0.042 (6) | 0.041 (6) | 0.054 (7) | 0.006 (4) | 0.002 (5) | 0.009 (5) |
C43 | 0.030 (5) | 0.033 (5) | 0.061 (7) | −0.003 (4) | 0.028 (5) | 0.006 (5) |
C44 | 0.051 (6) | 0.047 (6) | 0.047 (7) | −0.011 (5) | 0.007 (5) | −0.011 (5) |
C45 | 0.099 (10) | 0.057 (8) | 0.060 (8) | −0.032 (7) | 0.026 (7) | −0.022 (6) |
C46 | 0.114 (12) | 0.032 (7) | 0.094 (12) | 0.011 (7) | 0.038 (9) | −0.003 (7) |
C47 | 0.084 (9) | 0.047 (8) | 0.094 (11) | 0.015 (6) | 0.032 (8) | −0.011 (7) |
C48 | 0.040 (6) | 0.039 (6) | 0.071 (8) | 0.005 (4) | 0.013 (5) | −0.004 (5) |
C49 | 0.031 (5) | 0.031 (5) | 0.047 (6) | 0.005 (4) | 0.018 (4) | 0.008 (4) |
C50 | 0.034 (5) | 0.047 (6) | 0.062 (7) | 0.011 (4) | 0.022 (5) | 0.011 (5) |
C51 | 0.055 (7) | 0.068 (8) | 0.069 (8) | 0.014 (6) | 0.040 (6) | 0.003 (6) |
C52 | 0.043 (7) | 0.067 (8) | 0.093 (10) | 0.005 (5) | 0.035 (7) | 0.022 (7) |
C53 | 0.035 (6) | 0.064 (7) | 0.098 (11) | −0.012 (5) | 0.011 (6) | 0.012 (8) |
C54 | 0.030 (5) | 0.049 (6) | 0.052 (6) | −0.001 (4) | 0.011 (4) | 0.002 (5) |
Cl2 | 0.075 (2) | 0.0475 (18) | 0.095 (3) | −0.0003 (15) | 0.0363 (19) | −0.0004 (17) |
O1 | 0.107 (17) | 0.092 (16) | 0.14 (3) | 0.009 (13) | 0.023 (16) | 0.049 (17) |
O2 | 0.23 (4) | 0.23 (4) | 0.24 (4) | 0.00 (3) | 0.12 (3) | 0.02 (3) |
O3 | 0.26 (3) | 0.21 (3) | 0.14 (3) | −0.12 (3) | 0.02 (2) | 0.00 (2) |
O4 | 0.071 (16) | 0.094 (19) | 0.27 (4) | 0.030 (14) | 0.025 (17) | 0.03 (2) |
O1' | 0.12 (2) | 0.14 (2) | 0.14 (2) | 0.020 (17) | 0.048 (17) | −0.082 (19) |
O2' | 0.104 (18) | 0.13 (2) | 0.21 (4) | −0.051 (16) | 0.029 (19) | 0.04 (2) |
O3' | 0.34 (4) | 0.13 (3) | 0.11 (2) | 0.02 (3) | 0.10 (3) | 0.04 (2) |
O4' | 0.14 (3) | 0.14 (3) | 0.29 (4) | 0.03 (2) | 0.16 (3) | 0.00 (3) |
C55 | 0.140 (14) | 0.142 (14) | 0.133 (14) | 0.009 (9) | 0.052 (10) | 0.004 (9) |
Cl3 | 0.243 (9) | 0.213 (9) | 0.183 (9) | −0.001 (7) | 0.025 (7) | −0.020 (7) |
Cl4 | 0.273 (10) | 0.242 (10) | 0.216 (10) | 0.009 (7) | 0.148 (8) | −0.006 (7) |
C56 | 0.078 (13) | 0.102 (14) | 0.093 (14) | −0.030 (9) | 0.039 (9) | −0.007 (9) |
Cl5 | 0.132 (8) | 0.180 (9) | 0.160 (9) | −0.051 (7) | 0.081 (7) | −0.019 (7) |
Cl6 | 0.198 (11) | 0.235 (11) | 0.169 (11) | −0.027 (9) | 0.057 (8) | 0.001 (9) |
Pt1—P3 | 2.266 (2) | C28—H28 | 0.9300 |
Pt1—P1 | 2.359 (2) | C29—C30 | 1.404 (15) |
Pt1—Cl1 | 2.360 (2) | C29—H29 | 0.9300 |
Pt1—P2 | 2.368 (2) | C30—H30 | 0.9300 |
P1—C1 | 1.796 (11) | C31—C32 | 1.378 (14) |
P1—C7 | 1.822 (10) | C31—C36 | 1.382 (13) |
P1—C13 | 1.831 (9) | C32—C33 | 1.397 (16) |
P2—C19 | 1.806 (10) | C32—H32 | 0.9300 |
P2—C25 | 1.818 (9) | C33—C34 | 1.388 (19) |
P2—C31 | 1.829 (10) | C33—H33 | 0.9300 |
P3—C37 | 1.815 (9) | C34—C35 | 1.378 (18) |
P3—C43 | 1.823 (9) | C34—H34 | 0.9300 |
P3—C49 | 1.826 (9) | C35—C36 | 1.401 (14) |
C1—C6 | 1.375 (14) | C35—H35 | 0.9300 |
C1—C2 | 1.380 (14) | C36—H36 | 0.9300 |
C2—C3 | 1.424 (16) | C37—C38 | 1.355 (13) |
C2—H2 | 0.9300 | C37—C42 | 1.395 (12) |
C3—C4 | 1.348 (19) | C38—C39 | 1.397 (15) |
C3—H3 | 0.9300 | C38—H38 | 0.9300 |
C4—C5 | 1.35 (2) | C39—C40 | 1.354 (16) |
C4—H4 | 0.9300 | C39—H39 | 0.9300 |
C5—C6 | 1.379 (19) | C40—C41 | 1.402 (17) |
C5—H5 | 0.9300 | C40—H40 | 0.9300 |
C6—H6 | 0.9300 | C41—C42 | 1.351 (15) |
C7—C8 | 1.364 (15) | C41—H41 | 0.9300 |
C7—C12 | 1.412 (17) | C42—H42 | 0.9300 |
C8—C9 | 1.421 (19) | C43—C44 | 1.397 (13) |
C8—H8 | 0.9300 | C43—C48 | 1.420 (12) |
C9—C10 | 1.36 (3) | C44—C45 | 1.411 (15) |
C9—H9 | 0.9300 | C44—H44 | 0.9300 |
C10—C11 | 1.35 (3) | C45—C46 | 1.375 (19) |
C10—H10 | 0.9300 | C45—H45 | 0.9300 |
C11—C12 | 1.376 (19) | C46—C47 | 1.368 (19) |
C11—H11 | 0.9300 | C46—H46 | 0.9300 |
C12—H12 | 0.9300 | C47—C48 | 1.376 (15) |
C13—C14 | 1.351 (14) | C47—H47 | 0.9300 |
C13—C18 | 1.378 (15) | C48—H48 | 0.9300 |
C14—C15 | 1.383 (16) | C49—C54 | 1.367 (13) |
C14—H14 | 0.9300 | C49—C50 | 1.402 (14) |
C15—C16 | 1.34 (2) | C50—C51 | 1.366 (13) |
C15—H15 | 0.9300 | C50—H50 | 0.9300 |
C16—C17 | 1.40 (2) | C51—C52 | 1.376 (17) |
C16—H16 | 0.9300 | C51—H51 | 0.9300 |
C17—C18 | 1.394 (16) | C52—C53 | 1.353 (17) |
C17—H17 | 0.9300 | C52—H52 | 0.9300 |
C18—H18 | 0.9300 | C53—C54 | 1.402 (14) |
C19—C24 | 1.395 (12) | C53—H53 | 0.9300 |
C19—C20 | 1.414 (14) | C54—H54 | 0.9300 |
C20—C21 | 1.352 (15) | Cl2—O2' | 1.415 (9) |
C20—H20 | 0.9300 | Cl2—O1 | 1.420 (9) |
C21—C22 | 1.403 (16) | Cl2—O1' | 1.422 (9) |
C21—H21 | 0.9300 | Cl2—O4' | 1.428 (10) |
C22—C23 | 1.394 (18) | Cl2—O3 | 1.430 (10) |
C22—H22 | 0.9300 | Cl2—O2 | 1.431 (10) |
C23—C24 | 1.399 (15) | Cl2—O4 | 1.437 (9) |
C23—H23 | 0.9300 | Cl2—O3' | 1.438 (10) |
C24—H24 | 0.9300 | C55—Cl3 | 1.707 (10) |
C25—C26 | 1.373 (14) | C55—Cl4 | 1.719 (10) |
C25—C30 | 1.381 (13) | C55—H55A | 0.9700 |
C26—C27 | 1.391 (15) | C55—H55B | 0.9700 |
C26—H26 | 0.9300 | C56—Cl5 | 1.701 (10) |
C27—C28 | 1.369 (18) | C56—Cl6 | 1.721 (10) |
C27—H27 | 0.9300 | C56—H56A | 0.9700 |
C28—C29 | 1.389 (18) | C56—H56B | 0.9700 |
P3—Pt1—P1 | 98.91 (8) | C29—C30—H30 | 119.0 |
P3—Pt1—Cl1 | 169.58 (10) | C32—C31—C36 | 118.2 (10) |
P1—Pt1—Cl1 | 83.77 (9) | C32—C31—P2 | 122.6 (8) |
P3—Pt1—P2 | 95.87 (8) | C36—C31—P2 | 119.2 (8) |
P1—Pt1—P2 | 162.27 (8) | C31—C32—C33 | 121.6 (12) |
Cl1—Pt1—P2 | 83.43 (9) | C31—C32—H32 | 119.2 |
C1—P1—C7 | 108.6 (5) | C33—C32—H32 | 119.2 |
C1—P1—C13 | 105.5 (5) | C34—C33—C32 | 118.6 (13) |
C7—P1—C13 | 100.2 (4) | C34—C33—H33 | 120.7 |
C1—P1—Pt1 | 111.8 (3) | C32—C33—H33 | 120.7 |
C7—P1—Pt1 | 108.3 (3) | C35—C34—C33 | 121.3 (12) |
C13—P1—Pt1 | 121.3 (3) | C35—C34—H34 | 119.4 |
C19—P2—C25 | 108.2 (4) | C33—C34—H34 | 119.4 |
C19—P2—C31 | 104.0 (5) | C34—C35—C36 | 118.3 (11) |
C25—P2—C31 | 100.9 (4) | C34—C35—H35 | 120.8 |
C19—P2—Pt1 | 102.7 (3) | C36—C35—H35 | 120.8 |
C25—P2—Pt1 | 117.1 (3) | C31—C36—C35 | 122.0 (11) |
C31—P2—Pt1 | 122.7 (3) | C31—C36—H36 | 119.0 |
C37—P3—C43 | 109.7 (4) | C35—C36—H36 | 119.0 |
C37—P3—C49 | 102.8 (4) | C38—C37—C42 | 118.3 (9) |
C43—P3—C49 | 99.5 (4) | C38—C37—P3 | 116.5 (7) |
C37—P3—Pt1 | 114.1 (3) | C42—C37—P3 | 125.1 (8) |
C43—P3—Pt1 | 110.3 (3) | C37—C38—C39 | 121.0 (10) |
C49—P3—Pt1 | 119.1 (3) | C37—C38—H38 | 119.5 |
C6—C1—C2 | 118.4 (11) | C39—C38—H38 | 119.5 |
C6—C1—P1 | 123.0 (9) | C40—C39—C38 | 120.3 (11) |
C2—C1—P1 | 118.6 (8) | C40—C39—H39 | 119.9 |
C1—C2—C3 | 118.3 (11) | C38—C39—H39 | 119.9 |
C1—C2—H2 | 120.9 | C39—C40—C41 | 119.0 (11) |
C3—C2—H2 | 120.9 | C39—C40—H40 | 120.5 |
C4—C3—C2 | 122.9 (14) | C41—C40—H40 | 120.5 |
C4—C3—H3 | 118.5 | C42—C41—C40 | 120.1 (11) |
C2—C3—H3 | 118.5 | C42—C41—H41 | 120.0 |
C5—C4—C3 | 116.9 (15) | C40—C41—H41 | 120.0 |
C5—C4—H4 | 121.6 | C41—C42—C37 | 121.3 (10) |
C3—C4—H4 | 121.6 | C41—C42—H42 | 119.4 |
C4—C5—C6 | 123.0 (14) | C37—C42—H42 | 119.4 |
C4—C5—H5 | 118.5 | C44—C43—C48 | 117.9 (9) |
C6—C5—H5 | 118.5 | C44—C43—P3 | 121.5 (7) |
C1—C6—C5 | 120.5 (13) | C48—C43—P3 | 120.3 (7) |
C1—C6—H6 | 119.8 | C43—C44—C45 | 120.3 (11) |
C5—C6—H6 | 119.8 | C43—C44—H44 | 119.8 |
C8—C7—C12 | 119.5 (11) | C45—C44—H44 | 119.8 |
C8—C7—P1 | 122.6 (9) | C46—C45—C44 | 119.4 (12) |
C12—C7—P1 | 117.8 (9) | C46—C45—H45 | 120.3 |
C7—C8—C9 | 119.7 (14) | C44—C45—H45 | 120.3 |
C7—C8—H8 | 120.2 | C47—C46—C45 | 121.0 (11) |
C9—C8—H8 | 120.2 | C47—C46—H46 | 119.5 |
C10—C9—C8 | 117.7 (17) | C45—C46—H46 | 119.5 |
C10—C9—H9 | 121.2 | C46—C47—C48 | 120.7 (12) |
C8—C9—H9 | 121.2 | C46—C47—H47 | 119.7 |
C11—C10—C9 | 124.4 (18) | C48—C47—H47 | 119.7 |
C11—C10—H10 | 117.8 | C47—C48—C43 | 120.4 (11) |
C9—C10—H10 | 117.8 | C47—C48—H48 | 119.8 |
C10—C11—C12 | 118 (2) | C43—C48—H48 | 119.8 |
C10—C11—H11 | 120.9 | C54—C49—C50 | 118.3 (9) |
C12—C11—H11 | 120.9 | C54—C49—P3 | 123.8 (8) |
C11—C12—C7 | 120.5 (16) | C50—C49—P3 | 117.5 (7) |
C11—C12—H12 | 119.8 | C51—C50—C49 | 121.1 (10) |
C7—C12—H12 | 119.8 | C51—C50—H50 | 119.5 |
C14—C13—C18 | 118.1 (10) | C49—C50—H50 | 119.5 |
C14—C13—P1 | 123.5 (9) | C50—C51—C52 | 119.8 (12) |
C18—C13—P1 | 118.3 (8) | C50—C51—H51 | 120.1 |
C13—C14—C15 | 124.6 (13) | C52—C51—H51 | 120.1 |
C13—C14—H14 | 117.7 | C53—C52—C51 | 120.2 (10) |
C15—C14—H14 | 117.7 | C53—C52—H52 | 119.9 |
C16—C15—C14 | 116.3 (15) | C51—C52—H52 | 119.9 |
C16—C15—H15 | 121.9 | C52—C53—C54 | 120.5 (11) |
C14—C15—H15 | 121.9 | C52—C53—H53 | 119.8 |
C15—C16—C17 | 122.6 (15) | C54—C53—H53 | 119.8 |
C15—C16—H16 | 118.7 | C49—C54—C53 | 120.1 (11) |
C17—C16—H16 | 118.7 | C49—C54—H54 | 120.0 |
C18—C17—C16 | 118.5 (16) | C53—C54—H54 | 120.0 |
C18—C17—H17 | 120.8 | O2'—Cl2—O1 | 145.7 (14) |
C16—C17—H17 | 120.8 | O2'—Cl2—O1' | 111.6 (10) |
C13—C18—C17 | 119.9 (12) | O1—Cl2—O1' | 76.6 (13) |
C13—C18—H18 | 120.1 | O2'—Cl2—O4' | 110.2 (10) |
C17—C18—H18 | 120.1 | O1—Cl2—O4' | 96.6 (17) |
C24—C19—C20 | 117.5 (9) | O1'—Cl2—O4' | 110.4 (10) |
C24—C19—P2 | 123.8 (8) | O2'—Cl2—O3 | 49.3 (12) |
C20—C19—P2 | 118.6 (7) | O1—Cl2—O3 | 110.5 (9) |
C21—C20—C19 | 121.0 (11) | O1'—Cl2—O3 | 155.4 (15) |
C21—C20—H20 | 119.5 | O4'—Cl2—O3 | 92.5 (18) |
C19—C20—H20 | 119.5 | O2'—Cl2—O2 | 64.0 (13) |
C20—C21—C22 | 121.5 (12) | O1—Cl2—O2 | 111.0 (10) |
C20—C21—H21 | 119.2 | O1'—Cl2—O2 | 48.3 (13) |
C22—C21—H21 | 119.2 | O4'—Cl2—O2 | 135.1 (18) |
C23—C22—C21 | 118.8 (11) | O3—Cl2—O2 | 108.9 (10) |
C23—C22—H22 | 120.6 | O2'—Cl2—O4 | 104.3 (16) |
C21—C22—H22 | 120.6 | O1—Cl2—O4 | 109.1 (9) |
C22—C23—C24 | 119.5 (10) | O1'—Cl2—O4 | 89.6 (17) |
C22—C23—H23 | 120.3 | O4'—Cl2—O4 | 26.9 (19) |
C24—C23—H23 | 120.3 | O3—Cl2—O4 | 109.0 (10) |
C19—C24—C23 | 121.6 (10) | O2—Cl2—O4 | 108.4 (10) |
C19—C24—H24 | 119.2 | O2'—Cl2—O3' | 108.0 (10) |
C23—C24—H24 | 119.2 | O1—Cl2—O3' | 41.0 (13) |
C26—C25—C30 | 117.9 (9) | O1'—Cl2—O3' | 108.5 (10) |
C26—C25—P2 | 123.3 (7) | O4'—Cl2—O3' | 108.2 (10) |
C30—C25—P2 | 118.8 (8) | O3—Cl2—O3' | 70.8 (14) |
C25—C26—C27 | 122.5 (11) | O2—Cl2—O3' | 116.0 (18) |
C25—C26—H26 | 118.8 | O4—Cl2—O3' | 133.1 (18) |
C27—C26—H26 | 118.8 | Cl3—C55—Cl4 | 110.5 (8) |
C28—C27—C26 | 118.0 (12) | Cl3—C55—H55A | 109.6 |
C28—C27—H27 | 121.0 | Cl4—C55—H55A | 109.6 |
C26—C27—H27 | 121.0 | Cl3—C55—H55B | 109.6 |
C27—C28—C29 | 122.4 (12) | Cl4—C55—H55B | 109.6 |
C27—C28—H28 | 118.8 | H55A—C55—H55B | 108.1 |
C29—C28—H28 | 118.8 | Cl5—C56—Cl6 | 110.9 (9) |
C28—C29—C30 | 117.2 (12) | Cl5—C56—H56A | 109.5 |
C28—C29—H29 | 121.4 | Cl6—C56—H56A | 109.5 |
C30—C29—H29 | 121.4 | Cl5—C56—H56B | 109.5 |
C25—C30—C29 | 122.0 (11) | Cl6—C56—H56B | 109.5 |
C25—C30—H30 | 119.0 | H56A—C56—H56B | 108.0 |
P3—Pt1—P1—C1 | 91.9 (3) | C19—C20—C21—C22 | −1 (2) |
Cl1—Pt1—P1—C1 | −77.9 (3) | C20—C21—C22—C23 | 2 (2) |
P2—Pt1—P1—C1 | −121.9 (4) | C21—C22—C23—C24 | −1 (2) |
P3—Pt1—P1—C7 | −148.4 (4) | C20—C19—C24—C23 | 2.0 (17) |
Cl1—Pt1—P1—C7 | 41.8 (4) | P2—C19—C24—C23 | −179.1 (10) |
P2—Pt1—P1—C7 | −2.3 (5) | C22—C23—C24—C19 | −1 (2) |
P3—Pt1—P1—C13 | −33.5 (4) | C19—P2—C25—C26 | 114.6 (8) |
Cl1—Pt1—P1—C13 | 156.6 (4) | C31—P2—C25—C26 | −136.6 (8) |
P2—Pt1—P1—C13 | 112.6 (5) | Pt1—P2—C25—C26 | −0.8 (9) |
P3—Pt1—P2—C19 | 128.4 (3) | C19—P2—C25—C30 | −63.1 (8) |
P1—Pt1—P2—C19 | −18.0 (5) | C31—P2—C25—C30 | 45.8 (8) |
Cl1—Pt1—P2—C19 | −62.0 (3) | Pt1—P2—C25—C30 | −178.5 (6) |
P3—Pt1—P2—C25 | −113.2 (3) | C30—C25—C26—C27 | −2.5 (15) |
P1—Pt1—P2—C25 | 100.4 (4) | P2—C25—C26—C27 | 179.8 (8) |
Cl1—Pt1—P2—C25 | 56.4 (3) | C25—C26—C27—C28 | 3.7 (17) |
P3—Pt1—P2—C31 | 12.3 (4) | C26—C27—C28—C29 | −2.5 (19) |
P1—Pt1—P2—C31 | −134.1 (4) | C27—C28—C29—C30 | 0.3 (18) |
Cl1—Pt1—P2—C31 | −178.2 (4) | C26—C25—C30—C29 | 0.1 (15) |
P1—Pt1—P3—C37 | 111.1 (3) | P2—C25—C30—C29 | 177.9 (8) |
Cl1—Pt1—P3—C37 | −144.7 (5) | C28—C29—C30—C25 | 1.0 (16) |
P2—Pt1—P3—C37 | −59.1 (3) | C19—P2—C31—C32 | −17.0 (9) |
P1—Pt1—P3—C43 | −124.8 (3) | C25—P2—C31—C32 | −129.1 (8) |
Cl1—Pt1—P3—C43 | −20.7 (6) | Pt1—P2—C31—C32 | 98.5 (8) |
P2—Pt1—P3—C43 | 65.0 (3) | C19—P2—C31—C36 | 160.8 (7) |
P1—Pt1—P3—C49 | −10.8 (4) | C25—P2—C31—C36 | 48.7 (8) |
Cl1—Pt1—P3—C49 | 93.4 (6) | Pt1—P2—C31—C36 | −83.7 (8) |
P2—Pt1—P3—C49 | 179.1 (4) | C36—C31—C32—C33 | −0.5 (15) |
C7—P1—C1—C6 | 58.2 (10) | P2—C31—C32—C33 | 177.3 (9) |
C13—P1—C1—C6 | −48.5 (10) | C31—C32—C33—C34 | 0.4 (18) |
Pt1—P1—C1—C6 | 177.7 (8) | C32—C33—C34—C35 | 0 (2) |
C7—P1—C1—C2 | −122.1 (8) | C33—C34—C35—C36 | 0.3 (18) |
C13—P1—C1—C2 | 131.2 (8) | C32—C31—C36—C35 | 0.5 (14) |
Pt1—P1—C1—C2 | −2.6 (9) | P2—C31—C36—C35 | −177.4 (7) |
C6—C1—C2—C3 | 1.6 (15) | C34—C35—C36—C31 | −0.4 (15) |
P1—C1—C2—C3 | −178.1 (8) | C43—P3—C37—C38 | −173.7 (7) |
C1—C2—C3—C4 | −0.6 (19) | C49—P3—C37—C38 | 81.1 (8) |
C2—C3—C4—C5 | 1 (2) | Pt1—P3—C37—C38 | −49.3 (8) |
C3—C4—C5—C6 | −2 (2) | C43—P3—C37—C42 | 10.6 (9) |
C2—C1—C6—C5 | −2.8 (17) | C49—P3—C37—C42 | −94.6 (8) |
P1—C1—C6—C5 | 176.8 (10) | Pt1—P3—C37—C42 | 135.0 (7) |
C4—C5—C6—C1 | 3 (2) | C42—C37—C38—C39 | 2.1 (14) |
C1—P1—C7—C8 | −10.8 (10) | P3—C37—C38—C39 | −174.0 (8) |
C13—P1—C7—C8 | 99.5 (9) | C37—C38—C39—C40 | 0.5 (17) |
Pt1—P1—C7—C8 | −132.4 (8) | C38—C39—C40—C41 | −1.6 (17) |
C1—P1—C7—C12 | 173.7 (9) | C39—C40—C41—C42 | 0.2 (18) |
C13—P1—C7—C12 | −76.0 (10) | C40—C41—C42—C37 | 2.5 (17) |
Pt1—P1—C7—C12 | 52.0 (10) | C38—C37—C42—C41 | −3.5 (14) |
C12—C7—C8—C9 | −0.8 (17) | P3—C37—C42—C41 | 172.1 (8) |
P1—C7—C8—C9 | −176.2 (10) | C37—P3—C43—C44 | 133.3 (8) |
C7—C8—C9—C10 | 3 (2) | C49—P3—C43—C44 | −119.3 (8) |
C8—C9—C10—C11 | −2 (3) | Pt1—P3—C43—C44 | 6.7 (9) |
C9—C10—C11—C12 | −1 (3) | C37—P3—C43—C48 | −54.3 (9) |
C10—C11—C12—C7 | 3 (3) | C49—P3—C43—C48 | 53.1 (9) |
C8—C7—C12—C11 | −2 (2) | Pt1—P3—C43—C48 | 179.1 (7) |
P1—C7—C12—C11 | 173.3 (13) | C48—C43—C44—C45 | 6.6 (15) |
C1—P1—C13—C14 | −8.2 (10) | P3—C43—C44—C45 | 179.2 (9) |
C7—P1—C13—C14 | −121.0 (9) | C43—C44—C45—C46 | −1.9 (18) |
Pt1—P1—C13—C14 | 120.1 (8) | C44—C45—C46—C47 | −2 (2) |
C1—P1—C13—C18 | 168.0 (8) | C45—C46—C47—C48 | 1 (2) |
C7—P1—C13—C18 | 55.3 (9) | C46—C47—C48—C43 | 4 (2) |
Pt1—P1—C13—C18 | −63.7 (9) | C44—C43—C48—C47 | −7.5 (16) |
C18—C13—C14—C15 | −2.6 (17) | P3—C43—C48—C47 | 179.8 (10) |
P1—C13—C14—C15 | 173.6 (9) | C37—P3—C49—C54 | −8.2 (9) |
C13—C14—C15—C16 | 0 (2) | C43—P3—C49—C54 | −121.1 (8) |
C14—C15—C16—C17 | 3 (2) | Pt1—P3—C49—C54 | 119.1 (7) |
C15—C16—C17—C18 | −3 (2) | C37—P3—C49—C50 | 164.2 (7) |
C14—C13—C18—C17 | 3.0 (16) | C43—P3—C49—C50 | 51.3 (8) |
P1—C13—C18—C17 | −173.5 (9) | Pt1—P3—C49—C50 | −68.5 (8) |
C16—C17—C18—C13 | −0.6 (18) | C54—C49—C50—C51 | −3.3 (14) |
C25—P2—C19—C24 | 5.1 (10) | P3—C49—C50—C51 | −176.1 (8) |
C31—P2—C19—C24 | −101.5 (10) | C49—C50—C51—C52 | 2.0 (16) |
Pt1—P2—C19—C24 | 129.6 (9) | C50—C51—C52—C53 | −0.2 (18) |
C25—P2—C19—C20 | −176.0 (8) | C51—C52—C53—C54 | −0.4 (18) |
C31—P2—C19—C20 | 77.3 (9) | C50—C49—C54—C53 | 2.7 (14) |
Pt1—P2—C19—C20 | −51.5 (9) | P3—C49—C54—C53 | 175.1 (8) |
C24—C19—C20—C21 | −1.0 (18) | C52—C53—C54—C49 | −0.9 (17) |
P2—C19—C20—C21 | −179.9 (11) |