| Literature DB >> 21580540 |
Thomas Schnetz1, Frank Rominger, Peter Hofmann.
Abstract
The title compound, [Pd(4)(CH(2))(2)Cl(4)(C(28)H(40)P(2))(2)]·5C(4)H(8)O, possesses a tetra-nuclear palladium core with four bridging chlorido ligands and two bridging methyl-ene units, as well as two bridging anthracene-based bis-phosphine ligands. This tetra-nuclear complex can be considered as being composed of two μ-chlorido-bridged LPd(2) units. The structural motif of these LPd(2) units shows two doubly bridged palladium centers between the P atoms of the bis-phosphine ligand. One of these bridges is a μ-Cl atom, the other a μ-methyl-ene group. The coordination environment around each palladium center is essentially square planar. We ascribe the oxidation state +II to the palladium centers and do not assume Pd-Pd bonds [shortest distances 2.8110 (5) and 2.8109 (6) Å]. Co-crystallized with the palladium complex we found five non-coordinating tetra-hydro-furan solvent mol-ecules, one of which is disordered over two positions in a 0.429 (9):0.571 (8) ratio.Entities:
Year: 2010 PMID: 21580540 PMCID: PMC2984049 DOI: 10.1107/S1600536810010263
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Pd4(CH2)2Cl4(C28H40P2)2]·5C4H8O | |
| Triclinic, | |
| Hall symbol: -P 1 | |
| Mo | |
| Cell parameters from 5889 reflections | |
| µ = 1.13 mm−1 | |
| α = 79.877 (1)° | |
| β = 74.703 (1)° | Polyhedron, colourless |
| γ = 80.717 (1)° | 0.18 × 0.18 × 0.06 mm |
| Bruker SMART CCD diffractometer | 15292 independent reflections |
| Radiation source: fine-focus sealed tube | 9483 reflections with |
| graphite | |
| ω scans | θmax = 25.7°, θmin = 1.7° |
| Absorption correction: multi-scan ( | |
| 36611 measured reflections |
| Refinement on | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| Hydrogen site location: inferred from neighbouring sites | |
| H atoms treated by a mixture of independent and constrained refinement | |
| 15292 reflections | (Δ/σ)max = 0.001 |
| 915 parameters | Δρmax = 0.82 e Å−3 |
| 434 restraints | Δρmin = −0.73 e Å−3 |
| Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. |
| Refinement. Refinement of |
| Occ. (<1) | |||||
| Pd1 | 0.47930 (3) | 0.21727 (2) | 0.34085 (2) | 0.02319 (11) | |
| Pd2 | 0.24625 (3) | 0.22887 (3) | 0.38000 (2) | 0.02516 (11) | |
| Pd3 | 0.47029 (3) | 0.30751 (2) | 0.14456 (2) | 0.02341 (11) | |
| Pd4 | 0.23706 (3) | 0.32848 (3) | 0.18531 (2) | 0.02701 (12) | |
| Cl1 | 0.36596 (11) | 0.16459 (9) | 0.28118 (7) | 0.0361 (4) | |
| Cl2 | 0.35972 (11) | 0.38581 (9) | 0.23512 (8) | 0.0430 (4) | |
| Cl3 | 0.59914 (10) | 0.25954 (9) | 0.22297 (7) | 0.0339 (4) | |
| Cl4 | 0.11979 (11) | 0.29472 (11) | 0.30539 (7) | 0.0504 (5) | |
| C13 | 0.3675 (4) | 0.1783 (3) | 0.4288 (3) | 0.0288 (13) | |
| H13A | 0.373 (4) | 0.1221 (15) | 0.430 (2) | 0.020 (6)* | |
| H13B | 0.368 (4) | 0.190 (3) | 0.4733 (16) | 0.020 (6)* | |
| C14 | 0.3510 (4) | 0.3541 (3) | 0.0940 (3) | 0.0251 (13) | |
| H14A | 0.344 (4) | 0.332 (2) | 0.0546 (18) | 0.020 (6)* | |
| H14B | 0.357 (4) | 0.4093 (15) | 0.085 (2) | 0.020 (6)* | |
| P1 | 0.59170 (11) | 0.24153 (8) | 0.40365 (7) | 0.0233 (3) | |
| P2 | 0.12809 (11) | 0.25216 (8) | 0.48211 (7) | 0.0234 (3) | |
| P3 | 0.58086 (11) | 0.25881 (8) | 0.04890 (7) | 0.0220 (3) | |
| P4 | 0.11326 (11) | 0.30836 (9) | 0.12971 (7) | 0.0258 (3) | |
| C1 | 0.5481 (4) | 0.2807 (3) | 0.4894 (3) | 0.0237 (12) | |
| C2 | 0.6275 (4) | 0.2669 (3) | 0.5296 (3) | 0.0298 (13) | |
| H2 | 0.6915 | 0.2301 | 0.5163 | 0.036* | |
| C3 | 0.6167 (5) | 0.3044 (4) | 0.5876 (3) | 0.0357 (15) | |
| H3 | 0.6724 | 0.2928 | 0.6136 | 0.043* | |
| C4 | 0.5254 (4) | 0.3586 (3) | 0.6083 (3) | 0.0284 (13) | |
| H4 | 0.5192 | 0.3869 | 0.6465 | 0.034* | |
| C5 | 0.1723 (5) | 0.3546 (3) | 0.6725 (3) | 0.0369 (15) | |
| H5 | 0.1714 | 0.3818 | 0.7105 | 0.044* | |
| C6 | 0.0989 (4) | 0.2990 (4) | 0.6812 (3) | 0.0359 (15) | |
| H6 | 0.0515 | 0.2847 | 0.7264 | 0.043* | |
| C7 | 0.0959 (4) | 0.2652 (3) | 0.6240 (3) | 0.0319 (14) | |
| H7 | 0.0437 | 0.2289 | 0.6304 | 0.038* | |
| C8 | 0.1666 (4) | 0.2818 (3) | 0.5564 (3) | 0.0241 (12) | |
| C9 | 0.3453 (4) | 0.3529 (3) | 0.4850 (3) | 0.0210 (12) | |
| H9 | 0.3491 | 0.3241 | 0.4446 | 0.025* | |
| C10 | 0.3352 (4) | 0.4230 (3) | 0.5926 (3) | 0.0294 (13) | |
| H10 | 0.3321 | 0.4480 | 0.6351 | 0.035* | |
| C11 | 0.3217 (5) | 0.4861 (3) | 0.5282 (3) | 0.0371 (15) | |
| H11A | 0.2486 | 0.5186 | 0.5395 | 0.045* | |
| H11B | 0.3803 | 0.5215 | 0.5169 | 0.045* | |
| C12 | 0.3306 (4) | 0.4437 (3) | 0.4638 (3) | 0.0308 (13) | |
| H12A | 0.2627 | 0.4599 | 0.4460 | 0.037* | |
| H12B | 0.3948 | 0.4595 | 0.4252 | 0.037* | |
| C17 | 0.4513 (4) | 0.3315 (3) | 0.5133 (3) | 0.0217 (12) | |
| C18 | 0.4433 (4) | 0.3705 (3) | 0.5715 (3) | 0.0274 (13) | |
| C19 | 0.2483 (4) | 0.3315 (3) | 0.5492 (3) | 0.0230 (12) | |
| C20 | 0.2466 (4) | 0.3694 (3) | 0.6072 (3) | 0.0275 (13) | |
| C21 | 0.6853 (4) | 0.3135 (3) | 0.3499 (3) | 0.0307 (14) | |
| H21 | 0.7142 | 0.2958 | 0.3022 | 0.037* | |
| C22 | 0.6176 (5) | 0.3940 (3) | 0.3385 (3) | 0.0430 (16) | |
| H22A | 0.5531 | 0.3879 | 0.3217 | 0.064* | |
| H22B | 0.6638 | 0.4299 | 0.3031 | 0.064* | |
| H22C | 0.5922 | 0.4161 | 0.3833 | 0.064* | |
| C23 | 0.7874 (5) | 0.3200 (4) | 0.3761 (3) | 0.0456 (17) | |
| H23A | 0.8286 | 0.2673 | 0.3835 | 0.068* | |
| H23B | 0.7636 | 0.3421 | 0.4209 | 0.068* | |
| H23C | 0.8353 | 0.3547 | 0.3407 | 0.068* | |
| C25 | 0.6822 (4) | 0.1773 (3) | 0.0762 (3) | 0.0274 (13) | |
| H25 | 0.7117 | 0.1968 | 0.1116 | 0.033* | |
| C26 | 0.6233 (5) | 0.1063 (3) | 0.1158 (3) | 0.0389 (15) | |
| H26A | 0.5599 | 0.1235 | 0.1532 | 0.058* | |
| H26B | 0.6751 | 0.0671 | 0.1370 | 0.058* | |
| H26C | 0.5970 | 0.0824 | 0.0827 | 0.058* | |
| C27 | 0.7842 (4) | 0.1526 (4) | 0.0180 (3) | 0.0414 (16) | |
| H27A | 0.8208 | 0.1993 | −0.0062 | 0.062* | |
| H27B | 0.7606 | 0.1288 | −0.0163 | 0.062* | |
| H27C | 0.8363 | 0.1140 | 0.0395 | 0.062* | |
| C31 | 0.6835 (4) | 0.1482 (3) | 0.4194 (3) | 0.0321 (14) | |
| H31 | 0.7397 | 0.1594 | 0.4429 | 0.038* | |
| C32 | 0.6169 (5) | 0.0855 (3) | 0.4689 (3) | 0.0501 (18) | |
| H32A | 0.5795 | 0.1054 | 0.5138 | 0.075* | |
| H32B | 0.6670 | 0.0373 | 0.4780 | 0.075* | |
| H32C | 0.5613 | 0.0735 | 0.4469 | 0.075* | |
| C33 | 0.7457 (5) | 0.1193 (4) | 0.3483 (3) | 0.0468 (17) | |
| H33A | 0.7885 | 0.1607 | 0.3181 | 0.070* | |
| H33B | 0.6920 | 0.1077 | 0.3246 | 0.070* | |
| H33C | 0.7962 | 0.0713 | 0.3571 | 0.070* | |
| C35 | 0.6651 (5) | 0.3376 (3) | −0.0035 (3) | 0.0330 (14) | |
| H35 | 0.7242 | 0.3138 | −0.0415 | 0.040* | |
| C36 | 0.5920 (5) | 0.4037 (3) | −0.0393 (3) | 0.0535 (18) | |
| H36A | 0.5580 | 0.3813 | −0.0695 | 0.080* | |
| H36B | 0.6379 | 0.4440 | −0.0683 | 0.080* | |
| H36C | 0.5337 | 0.4281 | −0.0029 | 0.080* | |
| C37 | 0.7210 (5) | 0.3691 (4) | 0.0435 (3) | 0.056 (2) | |
| H37A | 0.7664 | 0.3255 | 0.0654 | 0.084* | |
| H37B | 0.6643 | 0.3937 | 0.0806 | 0.084* | |
| H37C | 0.7684 | 0.4087 | 0.0149 | 0.084* | |
| C41 | 0.0125 (4) | 0.3310 (3) | 0.4693 (3) | 0.0301 (13) | |
| H41 | −0.0166 | 0.3177 | 0.4309 | 0.036* | |
| C42 | 0.0557 (5) | 0.4103 (3) | 0.4422 (3) | 0.0423 (16) | |
| H42A | 0.1180 | 0.4054 | 0.4007 | 0.063* | |
| H42B | 0.0807 | 0.4276 | 0.4795 | 0.063* | |
| H42C | −0.0037 | 0.4494 | 0.4291 | 0.063* | |
| C43 | −0.0856 (5) | 0.3370 (4) | 0.5334 (3) | 0.0494 (18) | |
| H43A | −0.1126 | 0.2852 | 0.5498 | 0.074* | |
| H43B | −0.1452 | 0.3758 | 0.5202 | 0.074* | |
| H43C | −0.0621 | 0.3538 | 0.5715 | 0.074* | |
| C45 | 0.0110 (4) | 0.2437 (3) | 0.1876 (3) | 0.0341 (14) | |
| H45 | −0.0166 | 0.2655 | 0.2336 | 0.041* | |
| C46 | 0.0685 (5) | 0.1603 (4) | 0.2042 (3) | 0.0510 (18) | |
| H46A | 0.1336 | 0.1633 | 0.2216 | 0.077* | |
| H46B | 0.0920 | 0.1350 | 0.1611 | 0.077* | |
| H46C | 0.0168 | 0.1291 | 0.2405 | 0.077* | |
| C47 | −0.0916 (5) | 0.2408 (4) | 0.1605 (3) | 0.0503 (18) | |
| H47A | −0.1279 | 0.2947 | 0.1506 | 0.075* | |
| H47B | −0.1435 | 0.2094 | 0.1965 | 0.075* | |
| H47C | −0.0689 | 0.2163 | 0.1169 | 0.075* | |
| C51 | 0.0572 (4) | 0.1624 (3) | 0.5190 (3) | 0.0297 (13) | |
| H51 | −0.0046 | 0.1748 | 0.5607 | 0.036* | |
| C52 | 0.1377 (5) | 0.0938 (3) | 0.5439 (3) | 0.0471 (17) | |
| H52A | 0.1682 | 0.1094 | 0.5796 | 0.071* | |
| H52B | 0.1983 | 0.0804 | 0.5034 | 0.071* | |
| H52C | 0.0981 | 0.0475 | 0.5647 | 0.071* | |
| C53 | 0.0074 (5) | 0.1400 (4) | 0.4633 (3) | 0.0445 (16) | |
| H53A | −0.0442 | 0.1846 | 0.4484 | 0.067* | |
| H53B | −0.0325 | 0.0938 | 0.4836 | 0.067* | |
| H53C | 0.0670 | 0.1272 | 0.4221 | 0.067* | |
| C55 | 0.0288 (4) | 0.4056 (3) | 0.1131 (3) | 0.0326 (14) | |
| H55 | −0.0322 | 0.3968 | 0.0926 | 0.039* | |
| C56 | 0.0986 (5) | 0.4633 (3) | 0.0601 (3) | 0.0433 (16) | |
| H56A | 0.1310 | 0.4407 | 0.0159 | 0.065* | |
| H56B | 0.1582 | 0.4736 | 0.0795 | 0.065* | |
| H56C | 0.0519 | 0.5131 | 0.0504 | 0.065* | |
| C57 | −0.0237 (5) | 0.4382 (4) | 0.1828 (3) | 0.0507 (18) | |
| H57A | −0.0688 | 0.3998 | 0.2157 | 0.076* | |
| H57B | −0.0709 | 0.4880 | 0.1740 | 0.076* | |
| H57C | 0.0348 | 0.4478 | 0.2035 | 0.076* | |
| C61 | 0.5362 (4) | 0.2169 (3) | −0.0176 (3) | 0.0208 (12) | |
| C62 | 0.6145 (5) | 0.2129 (3) | −0.0826 (3) | 0.0335 (14) | |
| H62 | 0.6778 | 0.2402 | −0.0922 | 0.040* | |
| C63 | 0.6036 (5) | 0.1707 (3) | −0.1339 (3) | 0.0371 (15) | |
| H63 | 0.6582 | 0.1697 | −0.1775 | 0.045* | |
| C64 | 0.5121 (4) | 0.1301 (3) | −0.1204 (3) | 0.0316 (14) | |
| H64 | 0.5044 | 0.0994 | −0.1539 | 0.038* | |
| C65 | 0.1548 (5) | 0.1827 (4) | −0.0661 (3) | 0.0404 (16) | |
| H65 | 0.1552 | 0.1531 | −0.1024 | 0.049* | |
| C66 | 0.0753 (5) | 0.2472 (4) | −0.0516 (3) | 0.0433 (16) | |
| H66 | 0.0237 | 0.2641 | −0.0803 | 0.052* | |
| C67 | 0.0705 (4) | 0.2866 (3) | 0.0037 (3) | 0.0318 (14) | |
| H67 | 0.0136 | 0.3293 | 0.0136 | 0.038* | |
| C68 | 0.1480 (4) | 0.2657 (3) | 0.0465 (3) | 0.0247 (12) | |
| C69 | 0.3374 (4) | 0.1758 (3) | 0.0579 (3) | 0.0239 (12) | |
| H69 | 0.3418 | 0.2077 | 0.0945 | 0.029* | |
| C70 | 0.3274 (5) | 0.0963 (3) | −0.0395 (3) | 0.0360 (15) | |
| H70 | 0.3228 | 0.0681 | −0.0784 | 0.043* | |
| C71 | 0.3235 (5) | 0.0396 (3) | 0.0305 (3) | 0.0395 (15) | |
| H71A | 0.3852 | −0.0039 | 0.0235 | 0.047* | |
| H71B | 0.2527 | 0.0163 | 0.0456 | 0.047* | |
| C72 | 0.3337 (5) | 0.0862 (3) | 0.0879 (3) | 0.0335 (14) | |
| H72A | 0.4023 | 0.0646 | 0.1039 | 0.040* | |
| H72B | 0.2696 | 0.0800 | 0.1293 | 0.040* | |
| C77 | 0.4402 (4) | 0.1786 (3) | −0.0054 (3) | 0.0240 (12) | |
| C78 | 0.4326 (4) | 0.1349 (3) | −0.0579 (3) | 0.0255 (12) | |
| C79 | 0.2347 (4) | 0.2052 (3) | 0.0281 (3) | 0.0252 (13) | |
| C80 | 0.2345 (4) | 0.1623 (3) | −0.0263 (3) | 0.0326 (14) | |
| O80 | 0.1835 (5) | 0.6705 (3) | 0.1947 (3) | 0.0915 (19) | |
| C81 | 0.2354 (8) | 0.6670 (5) | 0.2510 (5) | 0.095 (3) | |
| H81A | 0.1924 | 0.7042 | 0.2840 | 0.114* | |
| H81B | 0.3112 | 0.6824 | 0.2319 | 0.114* | |
| C82 | 0.2408 (6) | 0.5849 (4) | 0.2891 (4) | 0.075 (2) | |
| H82A | 0.2285 | 0.5845 | 0.3408 | 0.090* | |
| H82B | 0.3130 | 0.5537 | 0.2712 | 0.090* | |
| C83 | 0.1470 (6) | 0.5538 (4) | 0.2719 (4) | 0.066 (2) | |
| H83A | 0.1613 | 0.4957 | 0.2721 | 0.080* | |
| H83B | 0.0754 | 0.5669 | 0.3059 | 0.080* | |
| C84 | 0.1476 (7) | 0.5960 (4) | 0.1998 (4) | 0.078 (3) | |
| H84A | 0.1984 | 0.5653 | 0.1638 | 0.094* | |
| H84B | 0.0721 | 0.6029 | 0.1916 | 0.094* | |
| O85 | 0.2286 (6) | −0.1162 (4) | 0.3862 (3) | 0.132 (3) | |
| C86 | 0.2504 (10) | −0.1239 (5) | 0.3145 (4) | 0.121 (4) | |
| H86A | 0.1959 | −0.1545 | 0.3064 | 0.146* | |
| H86B | 0.3258 | −0.1519 | 0.2985 | 0.146* | |
| C87 | 0.2416 (8) | −0.0422 (5) | 0.2748 (4) | 0.089 (3) | |
| H87A | 0.3159 | −0.0247 | 0.2536 | 0.106* | |
| H87B | 0.2025 | −0.0392 | 0.2368 | 0.106* | |
| C88 | 0.1768 (7) | 0.0059 (4) | 0.3300 (4) | 0.080 (2) | |
| H88A | 0.1943 | 0.0612 | 0.3186 | 0.096* | |
| H88B | 0.0960 | 0.0057 | 0.3369 | 0.096* | |
| C89 | 0.2148 (8) | −0.0357 (5) | 0.3923 (4) | 0.096 (3) | |
| H89A | 0.2859 | −0.0187 | 0.3932 | 0.116* | |
| H89B | 0.1591 | −0.0246 | 0.4365 | 0.116* | |
| O90 | 0.0116 (9) | −0.1175 (5) | 0.2291 (6) | 0.174 (4) | |
| C91 | 0.0593 (9) | −0.1076 (9) | 0.1565 (6) | 0.184 (8) | |
| H91A | 0.0489 | −0.1535 | 0.1362 | 0.220* | |
| H91B | 0.1401 | −0.1061 | 0.1484 | 0.220* | |
| C92 | 0.0106 (9) | −0.0350 (7) | 0.1205 (5) | 0.120 (4) | |
| H92A | −0.0069 | −0.0445 | 0.0768 | 0.144* | |
| H92B | 0.0606 | 0.0068 | 0.1082 | 0.144* | |
| C93 | −0.0921 (7) | −0.0134 (5) | 0.1748 (5) | 0.089 (3) | |
| H93A | −0.1055 | 0.0444 | 0.1756 | 0.107* | |
| H93B | −0.1575 | −0.0307 | 0.1653 | 0.107* | |
| C94 | −0.0704 (8) | −0.0555 (8) | 0.2414 (5) | 0.135 (4) | |
| H94A | −0.0475 | −0.0187 | 0.2665 | 0.162* | |
| H94B | −0.1391 | −0.0756 | 0.2720 | 0.162* | |
| O95 | 0.7300 (10) | 0.5637 (7) | 0.2061 (7) | 0.079 (4) | 0.429 (8) |
| C96 | 0.680 (2) | 0.6400 (9) | 0.1905 (16) | 0.090 (6) | 0.429 (8) |
| H96A | 0.7356 | 0.6726 | 0.1579 | 0.107* | 0.429 (8) |
| H96B | 0.6503 | 0.6644 | 0.2345 | 0.107* | 0.429 (8) |
| C97 | 0.591 (2) | 0.6369 (12) | 0.1573 (17) | 0.112 (6) | 0.429 (8) |
| H97A | 0.5889 | 0.6804 | 0.1176 | 0.134* | 0.429 (8) |
| H97B | 0.5178 | 0.6400 | 0.1921 | 0.134* | 0.429 (8) |
| C98 | 0.620 (2) | 0.5577 (13) | 0.1312 (16) | 0.102 (7) | 0.429 (8) |
| H98A | 0.5544 | 0.5279 | 0.1460 | 0.122* | 0.429 (8) |
| H98B | 0.6445 | 0.5645 | 0.0789 | 0.122* | 0.429 (8) |
| C99 | 0.7080 (17) | 0.5161 (9) | 0.1624 (11) | 0.071 (5) | 0.429 (8) |
| H99A | 0.6856 | 0.4654 | 0.1905 | 0.085* | 0.429 (8) |
| H99B | 0.7754 | 0.5042 | 0.1248 | 0.085* | 0.429 (8) |
| O95B | 0.5847 (12) | 0.5705 (7) | 0.2323 (5) | 0.133 (5) | 0.571 (8) |
| C96B | 0.612 (2) | 0.6465 (9) | 0.2023 (8) | 0.102 (6) | 0.571 (8) |
| H96C | 0.6551 | 0.6655 | 0.2300 | 0.123* | 0.571 (8) |
| H96D | 0.5437 | 0.6840 | 0.2017 | 0.123* | 0.571 (8) |
| C97B | 0.678 (2) | 0.6408 (10) | 0.1300 (8) | 0.114 (6) | 0.571 (8) |
| H97C | 0.7531 | 0.6558 | 0.1237 | 0.137* | 0.571 (8) |
| H97D | 0.6418 | 0.6758 | 0.0952 | 0.137* | 0.571 (8) |
| C98B | 0.6847 (17) | 0.5567 (10) | 0.1210 (9) | 0.107 (6) | 0.571 (8) |
| H98C | 0.6732 | 0.5520 | 0.0743 | 0.129* | 0.571 (8) |
| H98D | 0.7575 | 0.5274 | 0.1255 | 0.129* | 0.571 (8) |
| C99B | 0.5943 (15) | 0.5271 (9) | 0.1789 (8) | 0.090 (5) | 0.571 (8) |
| H99C | 0.5242 | 0.5348 | 0.1633 | 0.108* | 0.571 (8) |
| H99D | 0.6126 | 0.4700 | 0.1947 | 0.108* | 0.571 (8) |
| O100 | 0.6310 (6) | −0.0810 (3) | 0.2290 (3) | 0.094 (2) | |
| C101 | 0.6399 (8) | −0.1579 (4) | 0.2635 (4) | 0.091 (3) | |
| H10A | 0.7157 | −0.1848 | 0.2467 | 0.109* | |
| H10B | 0.5864 | −0.1879 | 0.2535 | 0.109* | |
| C102 | 0.6167 (7) | −0.1553 (5) | 0.3389 (4) | 0.089 (3) | |
| H10C | 0.6824 | −0.1788 | 0.3574 | 0.107* | |
| H10D | 0.5536 | −0.1850 | 0.3647 | 0.107* | |
| C103 | 0.5893 (10) | −0.0716 (5) | 0.3481 (4) | 0.130 (4) | |
| H10E | 0.5153 | −0.0624 | 0.3808 | 0.156* | |
| H10F | 0.6451 | −0.0544 | 0.3675 | 0.156* | |
| C104 | 0.5895 (8) | −0.0291 (4) | 0.2784 (4) | 0.089 (3) | |
| H10G | 0.5131 | −0.0058 | 0.2762 | 0.107* | |
| H10H | 0.6363 | 0.0145 | 0.2680 | 0.107* |
| Pd1 | 0.0153 (2) | 0.0337 (3) | 0.0231 (2) | −0.00019 (18) | −0.00609 (18) | −0.01090 (19) |
| Pd2 | 0.0153 (2) | 0.0391 (3) | 0.0236 (2) | −0.00203 (19) | −0.00592 (18) | −0.0102 (2) |
| Pd3 | 0.0175 (2) | 0.0314 (3) | 0.0243 (2) | −0.00120 (18) | −0.00655 (18) | −0.01135 (19) |
| Pd4 | 0.0174 (2) | 0.0401 (3) | 0.0253 (3) | 0.00263 (19) | −0.00767 (19) | −0.0111 (2) |
| Cl1 | 0.0238 (7) | 0.0553 (10) | 0.0362 (9) | −0.0054 (7) | −0.0060 (6) | −0.0261 (7) |
| Cl2 | 0.0267 (8) | 0.0601 (11) | 0.0519 (10) | 0.0057 (7) | −0.0123 (7) | −0.0394 (8) |
| Cl3 | 0.0186 (7) | 0.0640 (10) | 0.0220 (8) | −0.0036 (7) | −0.0059 (6) | −0.0136 (7) |
| Cl4 | 0.0196 (8) | 0.1063 (14) | 0.0236 (8) | 0.0052 (8) | −0.0084 (6) | −0.0112 (9) |
| C13 | 0.022 (3) | 0.035 (3) | 0.030 (3) | −0.003 (3) | −0.007 (3) | −0.006 (3) |
| C14 | 0.023 (3) | 0.024 (3) | 0.031 (3) | −0.002 (2) | −0.008 (3) | −0.009 (3) |
| P1 | 0.0143 (7) | 0.0337 (9) | 0.0235 (8) | −0.0005 (6) | −0.0064 (6) | −0.0081 (6) |
| P2 | 0.0138 (7) | 0.0324 (9) | 0.0249 (8) | 0.0005 (6) | −0.0062 (6) | −0.0067 (6) |
| P3 | 0.0185 (7) | 0.0271 (8) | 0.0217 (8) | −0.0038 (6) | −0.0051 (6) | −0.0060 (6) |
| P4 | 0.0188 (7) | 0.0350 (9) | 0.0242 (8) | −0.0015 (6) | −0.0081 (6) | −0.0026 (7) |
| C1 | 0.024 (3) | 0.028 (3) | 0.021 (3) | −0.007 (2) | −0.008 (2) | −0.004 (2) |
| C2 | 0.022 (3) | 0.043 (4) | 0.024 (3) | 0.003 (3) | −0.008 (2) | −0.006 (3) |
| C3 | 0.026 (3) | 0.059 (4) | 0.025 (3) | −0.011 (3) | −0.008 (3) | −0.006 (3) |
| C4 | 0.027 (3) | 0.043 (4) | 0.020 (3) | −0.010 (3) | −0.006 (2) | −0.012 (3) |
| C5 | 0.030 (3) | 0.050 (4) | 0.029 (4) | 0.006 (3) | −0.002 (3) | −0.017 (3) |
| C6 | 0.025 (3) | 0.058 (4) | 0.020 (3) | −0.004 (3) | 0.004 (2) | −0.006 (3) |
| C7 | 0.024 (3) | 0.047 (4) | 0.026 (3) | −0.008 (3) | −0.006 (3) | −0.005 (3) |
| C8 | 0.016 (3) | 0.032 (3) | 0.023 (3) | 0.004 (2) | −0.005 (2) | −0.006 (2) |
| C9 | 0.014 (3) | 0.030 (3) | 0.020 (3) | 0.000 (2) | −0.006 (2) | −0.005 (2) |
| C10 | 0.031 (3) | 0.028 (3) | 0.034 (3) | 0.002 (3) | −0.011 (3) | −0.015 (3) |
| C11 | 0.043 (4) | 0.031 (3) | 0.040 (4) | −0.005 (3) | −0.011 (3) | −0.010 (3) |
| C12 | 0.030 (3) | 0.031 (3) | 0.028 (3) | 0.000 (3) | −0.008 (3) | 0.001 (3) |
| C17 | 0.016 (3) | 0.029 (3) | 0.020 (3) | −0.004 (2) | −0.005 (2) | −0.001 (2) |
| C18 | 0.028 (3) | 0.031 (3) | 0.023 (3) | −0.011 (3) | −0.004 (2) | 0.000 (2) |
| C19 | 0.020 (3) | 0.025 (3) | 0.023 (3) | 0.007 (2) | −0.009 (2) | −0.003 (2) |
| C20 | 0.021 (3) | 0.030 (3) | 0.032 (3) | 0.005 (2) | −0.009 (3) | −0.010 (3) |
| C21 | 0.024 (3) | 0.052 (4) | 0.019 (3) | −0.014 (3) | −0.003 (2) | −0.006 (3) |
| C22 | 0.048 (4) | 0.048 (4) | 0.037 (4) | −0.021 (3) | −0.009 (3) | −0.006 (3) |
| C23 | 0.032 (4) | 0.080 (5) | 0.032 (4) | −0.022 (3) | −0.005 (3) | −0.014 (3) |
| C25 | 0.021 (3) | 0.036 (3) | 0.028 (3) | 0.000 (2) | −0.007 (2) | −0.010 (3) |
| C26 | 0.038 (4) | 0.036 (4) | 0.043 (4) | 0.008 (3) | −0.016 (3) | −0.007 (3) |
| C27 | 0.024 (3) | 0.060 (4) | 0.040 (4) | 0.010 (3) | −0.008 (3) | −0.019 (3) |
| C31 | 0.025 (3) | 0.038 (4) | 0.037 (4) | 0.008 (3) | −0.015 (3) | −0.012 (3) |
| C32 | 0.049 (4) | 0.037 (4) | 0.056 (5) | 0.014 (3) | −0.015 (4) | −0.003 (3) |
| C33 | 0.042 (4) | 0.053 (4) | 0.043 (4) | 0.022 (3) | −0.013 (3) | −0.021 (3) |
| C35 | 0.033 (3) | 0.037 (4) | 0.029 (3) | −0.013 (3) | −0.001 (3) | −0.007 (3) |
| C36 | 0.054 (4) | 0.036 (4) | 0.060 (5) | −0.010 (3) | −0.003 (4) | 0.008 (3) |
| C37 | 0.054 (4) | 0.075 (5) | 0.048 (4) | −0.045 (4) | −0.002 (3) | −0.015 (4) |
| C41 | 0.026 (3) | 0.038 (4) | 0.027 (3) | 0.002 (3) | −0.010 (3) | −0.008 (3) |
| C42 | 0.038 (4) | 0.035 (4) | 0.056 (4) | 0.004 (3) | −0.023 (3) | −0.005 (3) |
| C43 | 0.031 (4) | 0.076 (5) | 0.037 (4) | 0.022 (3) | −0.012 (3) | −0.018 (3) |
| C45 | 0.022 (3) | 0.050 (4) | 0.028 (3) | −0.008 (3) | −0.004 (3) | 0.001 (3) |
| C46 | 0.036 (4) | 0.054 (4) | 0.053 (4) | −0.016 (3) | 0.001 (3) | 0.012 (3) |
| C47 | 0.026 (3) | 0.081 (5) | 0.045 (4) | −0.019 (3) | −0.008 (3) | 0.000 (4) |
| C51 | 0.020 (3) | 0.035 (3) | 0.030 (3) | −0.005 (2) | 0.001 (2) | −0.004 (3) |
| C52 | 0.045 (4) | 0.032 (4) | 0.063 (5) | −0.008 (3) | −0.016 (3) | 0.003 (3) |
| C53 | 0.043 (4) | 0.043 (4) | 0.057 (4) | −0.013 (3) | −0.023 (3) | −0.010 (3) |
| C55 | 0.028 (3) | 0.036 (4) | 0.037 (4) | 0.003 (3) | −0.018 (3) | −0.002 (3) |
| C56 | 0.048 (4) | 0.034 (4) | 0.050 (4) | −0.003 (3) | −0.022 (3) | 0.004 (3) |
| C57 | 0.053 (4) | 0.049 (4) | 0.048 (4) | 0.014 (3) | −0.015 (3) | −0.016 (3) |
| C61 | 0.018 (3) | 0.023 (3) | 0.021 (3) | 0.001 (2) | −0.006 (2) | −0.004 (2) |
| C62 | 0.031 (3) | 0.041 (4) | 0.028 (3) | −0.011 (3) | −0.003 (3) | −0.005 (3) |
| C63 | 0.035 (4) | 0.052 (4) | 0.023 (3) | −0.002 (3) | −0.002 (3) | −0.012 (3) |
| C64 | 0.034 (3) | 0.034 (3) | 0.030 (3) | 0.005 (3) | −0.011 (3) | −0.017 (3) |
| C65 | 0.043 (4) | 0.050 (4) | 0.040 (4) | −0.010 (3) | −0.020 (3) | −0.019 (3) |
| C66 | 0.031 (4) | 0.063 (5) | 0.043 (4) | −0.005 (3) | −0.020 (3) | −0.010 (3) |
| C67 | 0.020 (3) | 0.048 (4) | 0.028 (3) | 0.000 (3) | −0.009 (3) | −0.007 (3) |
| C68 | 0.021 (3) | 0.029 (3) | 0.026 (3) | −0.006 (2) | −0.009 (2) | −0.003 (2) |
| C69 | 0.023 (3) | 0.022 (3) | 0.030 (3) | −0.005 (2) | −0.011 (2) | −0.004 (2) |
| C70 | 0.040 (4) | 0.036 (4) | 0.040 (4) | −0.004 (3) | −0.018 (3) | −0.016 (3) |
| C71 | 0.035 (4) | 0.029 (3) | 0.056 (4) | −0.011 (3) | −0.007 (3) | −0.009 (3) |
| C72 | 0.033 (3) | 0.030 (3) | 0.038 (4) | −0.008 (3) | −0.012 (3) | 0.001 (3) |
| C77 | 0.026 (3) | 0.018 (3) | 0.028 (3) | 0.002 (2) | −0.012 (2) | 0.000 (2) |
| C78 | 0.026 (3) | 0.030 (3) | 0.024 (3) | −0.001 (2) | −0.011 (3) | −0.009 (2) |
| C79 | 0.023 (3) | 0.034 (3) | 0.023 (3) | −0.012 (3) | −0.007 (2) | −0.004 (2) |
| C80 | 0.029 (3) | 0.034 (3) | 0.040 (4) | −0.011 (3) | −0.013 (3) | −0.004 (3) |
| O80 | 0.132 (5) | 0.070 (4) | 0.068 (4) | −0.040 (4) | −0.005 (4) | −0.001 (3) |
| C81 | 0.107 (8) | 0.091 (8) | 0.086 (7) | −0.048 (6) | −0.003 (6) | −0.005 (6) |
| C82 | 0.078 (6) | 0.053 (5) | 0.083 (6) | −0.003 (4) | 0.003 (5) | −0.025 (5) |
| C83 | 0.055 (5) | 0.045 (5) | 0.078 (6) | −0.002 (4) | 0.016 (4) | −0.006 (4) |
| C84 | 0.087 (6) | 0.076 (6) | 0.066 (6) | −0.035 (5) | 0.020 (5) | −0.030 (5) |
| O85 | 0.192 (8) | 0.086 (5) | 0.080 (5) | 0.053 (5) | −0.016 (5) | 0.000 (4) |
| C86 | 0.216 (13) | 0.072 (7) | 0.062 (6) | 0.029 (7) | −0.023 (7) | −0.030 (5) |
| C87 | 0.125 (8) | 0.086 (7) | 0.050 (5) | 0.005 (6) | −0.023 (5) | −0.010 (5) |
| C88 | 0.088 (7) | 0.067 (6) | 0.091 (7) | −0.003 (5) | −0.042 (6) | −0.008 (5) |
| C89 | 0.124 (9) | 0.084 (7) | 0.081 (7) | 0.006 (6) | −0.035 (6) | −0.016 (6) |
| O90 | 0.161 (9) | 0.121 (7) | 0.222 (11) | −0.004 (6) | −0.038 (8) | −0.003 (7) |
| C91 | 0.090 (9) | 0.36 (2) | 0.109 (10) | 0.087 (11) | −0.025 (8) | −0.158 (13) |
| C92 | 0.101 (9) | 0.169 (12) | 0.092 (8) | −0.061 (8) | 0.008 (7) | −0.032 (8) |
| C93 | 0.072 (7) | 0.078 (6) | 0.125 (9) | −0.013 (5) | −0.036 (7) | −0.012 (6) |
| C94 | 0.070 (8) | 0.192 (14) | 0.117 (10) | 0.002 (8) | 0.009 (7) | −0.018 (10) |
| O95 | 0.079 (9) | 0.079 (8) | 0.098 (10) | 0.016 (7) | −0.055 (8) | −0.037 (7) |
| C96 | 0.117 (15) | 0.074 (9) | 0.090 (15) | −0.010 (10) | −0.058 (12) | 0.003 (10) |
| C97 | 0.142 (14) | 0.099 (11) | 0.117 (14) | 0.035 (11) | −0.096 (11) | −0.023 (11) |
| C98 | 0.110 (16) | 0.103 (13) | 0.114 (16) | 0.025 (12) | −0.081 (12) | −0.026 (12) |
| C99 | 0.093 (12) | 0.077 (10) | 0.052 (11) | 0.005 (9) | −0.049 (9) | −0.004 (8) |
| O95B | 0.203 (14) | 0.092 (8) | 0.075 (7) | −0.028 (8) | 0.022 (8) | −0.010 (6) |
| C96B | 0.162 (16) | 0.072 (8) | 0.075 (10) | −0.012 (10) | −0.027 (11) | −0.021 (7) |
| C97B | 0.142 (14) | 0.100 (10) | 0.090 (11) | −0.063 (11) | 0.010 (10) | 0.001 (9) |
| C98B | 0.124 (14) | 0.107 (10) | 0.079 (10) | 0.020 (11) | −0.007 (9) | −0.037 (9) |
| C99B | 0.137 (13) | 0.071 (9) | 0.082 (10) | −0.040 (9) | −0.062 (9) | 0.017 (7) |
| O100 | 0.168 (6) | 0.062 (4) | 0.072 (4) | −0.023 (4) | −0.059 (4) | −0.006 (3) |
| C101 | 0.140 (9) | 0.049 (6) | 0.091 (7) | 0.003 (5) | −0.048 (6) | −0.015 (5) |
| C102 | 0.105 (7) | 0.086 (7) | 0.071 (7) | −0.033 (6) | −0.020 (5) | 0.024 (5) |
| C103 | 0.232 (14) | 0.077 (7) | 0.057 (7) | −0.033 (8) | 0.010 (7) | −0.004 (5) |
| C104 | 0.128 (8) | 0.053 (5) | 0.086 (7) | 0.011 (5) | −0.037 (6) | −0.011 (5) |
| Pd1—C13 | 2.014 (6) | C52—H52B | 0.9800 |
| Pd1—P1 | 2.2393 (13) | C52—H52C | 0.9800 |
| Pd1—Cl1 | 2.4360 (13) | C53—H53A | 0.9800 |
| Pd1—Cl3 | 2.4767 (14) | C53—H53B | 0.9800 |
| Pd1—Pd2 | 2.8110 (5) | C53—H53C | 0.9800 |
| Pd2—C13 | 2.017 (5) | C55—C56 | 1.515 (7) |
| Pd2—P2 | 2.2251 (14) | C55—C57 | 1.524 (7) |
| Pd2—Cl1 | 2.4465 (14) | C55—H55 | 1.0000 |
| Pd2—Cl4 | 2.4621 (14) | C56—H56A | 0.9800 |
| Pd3—C14 | 2.004 (5) | C56—H56B | 0.9800 |
| Pd3—P3 | 2.2380 (14) | C56—H56C | 0.9800 |
| Pd3—Cl2 | 2.4284 (14) | C57—H57A | 0.9800 |
| Pd3—Cl3 | 2.4807 (13) | C57—H57B | 0.9800 |
| Pd3—Pd4 | 2.8109 (6) | C57—H57C | 0.9800 |
| Pd4—C14 | 2.016 (5) | C61—C62 | 1.402 (7) |
| Pd4—P4 | 2.2281 (14) | C61—C77 | 1.416 (7) |
| Pd4—Cl2 | 2.4429 (14) | C62—C63 | 1.394 (7) |
| Pd4—Cl4 | 2.4676 (15) | C62—H62 | 0.9500 |
| C13—H13A | 0.96 (2) | C63—C64 | 1.386 (7) |
| C13—H13B | 0.94 (2) | C63—H63 | 0.9500 |
| C14—H14A | 0.95 (2) | C64—C78 | 1.374 (7) |
| C14—H14B | 0.95 (2) | C64—H64 | 0.9500 |
| P1—C21 | 1.847 (5) | C65—C66 | 1.387 (8) |
| P1—C1 | 1.850 (5) | C65—C80 | 1.397 (7) |
| P1—C31 | 1.856 (5) | C65—H65 | 0.9500 |
| P2—C8 | 1.836 (5) | C66—C67 | 1.370 (7) |
| P2—C51 | 1.854 (5) | C66—H66 | 0.9500 |
| P2—C41 | 1.862 (5) | C67—C68 | 1.418 (7) |
| P3—C25 | 1.848 (5) | C67—H67 | 0.9500 |
| P3—C61 | 1.850 (5) | C68—C79 | 1.405 (7) |
| P3—C35 | 1.854 (5) | C69—C79 | 1.536 (7) |
| P4—C68 | 1.838 (5) | C69—C77 | 1.544 (7) |
| P4—C45 | 1.857 (5) | C69—C72 | 1.562 (7) |
| P4—C55 | 1.864 (5) | C69—H69 | 1.0000 |
| C1—C2 | 1.400 (7) | C70—C80 | 1.500 (8) |
| C1—C17 | 1.406 (7) | C70—C78 | 1.508 (7) |
| C2—C3 | 1.381 (7) | C70—C71 | 1.541 (8) |
| C2—H2 | 0.9500 | C70—H70 | 1.0000 |
| C3—C4 | 1.379 (7) | C71—C72 | 1.544 (7) |
| C3—H3 | 0.9500 | C71—H71A | 0.9900 |
| C4—C18 | 1.382 (7) | C71—H71B | 0.9900 |
| C4—H4 | 0.9500 | C72—H72A | 0.9900 |
| C5—C20 | 1.389 (7) | C72—H72B | 0.9900 |
| C5—C6 | 1.396 (8) | C77—C78 | 1.416 (7) |
| C5—H5 | 0.9500 | C79—C80 | 1.408 (7) |
| C6—C7 | 1.372 (7) | O80—C84 | 1.410 (7) |
| C6—H6 | 0.9500 | O80—C81 | 1.419 (8) |
| C7—C8 | 1.407 (7) | C81—C82 | 1.485 (8) |
| C7—H7 | 0.9500 | C81—H81A | 0.9900 |
| C8—C19 | 1.407 (7) | C81—H81B | 0.9900 |
| C9—C17 | 1.545 (6) | C82—C83 | 1.509 (8) |
| C9—C12 | 1.545 (7) | C82—H82A | 0.9900 |
| C9—C19 | 1.549 (7) | C82—H82B | 0.9900 |
| C9—H9 | 1.0000 | C83—C84 | 1.481 (8) |
| C10—C20 | 1.501 (7) | C83—H83A | 0.9900 |
| C10—C18 | 1.510 (7) | C83—H83B | 0.9900 |
| C10—C11 | 1.550 (7) | C84—H84A | 0.9900 |
| C10—H10 | 1.0000 | C84—H84B | 0.9900 |
| C11—C12 | 1.546 (7) | O85—C86 | 1.396 (8) |
| C11—H11A | 0.9900 | O85—C89 | 1.398 (8) |
| C11—H11B | 0.9900 | C86—C87 | 1.493 (9) |
| C12—H12A | 0.9900 | C86—H86A | 0.9900 |
| C12—H12B | 0.9900 | C86—H86B | 0.9900 |
| C17—C18 | 1.406 (7) | C87—C88 | 1.476 (8) |
| C19—C20 | 1.409 (7) | C87—H87A | 0.9900 |
| C21—C22 | 1.524 (8) | C87—H87B | 0.9900 |
| C21—C23 | 1.531 (7) | C88—C89 | 1.466 (8) |
| C21—H21 | 1.0000 | C88—H88A | 0.9900 |
| C22—H22A | 0.9800 | C88—H88B | 0.9900 |
| C22—H22B | 0.9800 | C89—H89A | 0.9900 |
| C22—H22C | 0.9800 | C89—H89B | 0.9900 |
| C23—H23A | 0.9800 | O90—C94 | 1.368 (9) |
| C23—H23B | 0.9800 | O90—C91 | 1.392 (10) |
| C23—H23C | 0.9800 | C91—C92 | 1.459 (11) |
| C25—C26 | 1.524 (7) | C91—H91A | 0.9900 |
| C25—C27 | 1.539 (7) | C91—H91B | 0.9900 |
| C25—H25 | 1.0000 | C92—C93 | 1.488 (9) |
| C26—H26A | 0.9800 | C92—H92A | 0.9900 |
| C26—H26B | 0.9800 | C92—H92B | 0.9900 |
| C26—H26C | 0.9800 | C93—C94 | 1.458 (10) |
| C27—H27A | 0.9800 | C93—H93A | 0.9900 |
| C27—H27B | 0.9800 | C93—H93B | 0.9900 |
| C27—H27C | 0.9800 | C94—H94A | 0.9900 |
| C31—C32 | 1.523 (8) | C94—H94B | 0.9900 |
| C31—C33 | 1.541 (7) | O95—C96 | 1.386 (12) |
| C31—H31 | 1.0000 | O95—C99 | 1.395 (12) |
| C32—H32A | 0.9800 | C96—C97 | 1.457 (13) |
| C32—H32B | 0.9800 | C96—H96A | 0.9900 |
| C32—H32C | 0.9800 | C96—H96B | 0.9900 |
| C33—H33A | 0.9800 | C97—C98 | 1.503 (14) |
| C33—H33B | 0.9800 | C97—H97A | 0.9900 |
| C33—H33C | 0.9800 | C97—H97B | 0.9900 |
| C35—C37 | 1.517 (7) | C98—C99 | 1.442 (13) |
| C35—C36 | 1.540 (8) | C98—H98A | 0.9900 |
| C35—H35 | 1.0000 | C98—H98B | 0.9900 |
| C36—H36A | 0.9800 | C99—H99A | 0.9900 |
| C36—H36B | 0.9800 | C99—H99B | 0.9900 |
| C36—H36C | 0.9800 | O95B—C99B | 1.369 (11) |
| C37—H37A | 0.9800 | O95B—C96B | 1.400 (12) |
| C37—H37B | 0.9800 | C96B—C97B | 1.462 (13) |
| C37—H37C | 0.9800 | C96B—H96C | 0.9900 |
| C41—C42 | 1.513 (7) | C96B—H96D | 0.9900 |
| C41—C43 | 1.523 (7) | C97B—C98B | 1.481 (13) |
| C41—H41 | 1.0000 | C97B—H97C | 0.9900 |
| C42—H42A | 0.9800 | C97B—H97D | 0.9900 |
| C42—H42B | 0.9800 | C98B—C99B | 1.469 (13) |
| C42—H42C | 0.9800 | C98B—H98C | 0.9900 |
| C43—H43A | 0.9800 | C98B—H98D | 0.9900 |
| C43—H43B | 0.9800 | C99B—H99C | 0.9900 |
| C43—H43C | 0.9800 | C99B—H99D | 0.9900 |
| C45—C46 | 1.526 (8) | O100—C101 | 1.385 (7) |
| C45—C47 | 1.533 (7) | O100—C104 | 1.386 (7) |
| C45—H45 | 1.0000 | C101—C102 | 1.449 (8) |
| C46—H46A | 0.9800 | C101—H10A | 0.9900 |
| C46—H46B | 0.9800 | C101—H10B | 0.9900 |
| C46—H46C | 0.9800 | C102—C103 | 1.463 (9) |
| C47—H47A | 0.9800 | C102—H10C | 0.9900 |
| C47—H47B | 0.9800 | C102—H10D | 0.9900 |
| C47—H47C | 0.9800 | C103—C104 | 1.441 (8) |
| C51—C53 | 1.532 (7) | C103—H10E | 0.9900 |
| C51—C52 | 1.532 (7) | C103—H10F | 0.9900 |
| C51—H51 | 1.0000 | C104—H10G | 0.9900 |
| C52—H52A | 0.9800 | C104—H10H | 0.9900 |
| C13—Pd1—P1 | 92.48 (16) | H47B—C47—H47C | 109.5 |
| C13—Pd1—Cl1 | 83.25 (16) | C53—C51—C52 | 110.9 (5) |
| P1—Pd1—Cl1 | 169.09 (5) | C53—C51—P2 | 109.8 (4) |
| C13—Pd1—Cl3 | 171.59 (16) | C52—C51—P2 | 110.7 (4) |
| P1—Pd1—Cl3 | 95.90 (5) | C53—C51—H51 | 108.4 |
| Cl1—Pd1—Cl3 | 88.39 (5) | C52—C51—H51 | 108.4 |
| C13—Pd1—Pd2 | 45.84 (15) | P2—C51—H51 | 108.4 |
| P1—Pd1—Pd2 | 127.42 (4) | C51—C52—H52A | 109.5 |
| Cl1—Pd1—Pd2 | 55.02 (3) | C51—C52—H52B | 109.5 |
| Cl3—Pd1—Pd2 | 127.57 (3) | H52A—C52—H52B | 109.5 |
| C13—Pd2—P2 | 92.22 (16) | C51—C52—H52C | 109.5 |
| C13—Pd2—Cl1 | 82.90 (16) | H52A—C52—H52C | 109.5 |
| P2—Pd2—Cl1 | 163.70 (6) | H52B—C52—H52C | 109.5 |
| C13—Pd2—Cl4 | 171.82 (16) | C51—C53—H53A | 109.5 |
| P2—Pd2—Cl4 | 95.20 (5) | C51—C53—H53B | 109.5 |
| Cl1—Pd2—Cl4 | 90.85 (5) | H53A—C53—H53B | 109.5 |
| C13—Pd2—Pd1 | 45.73 (16) | C51—C53—H53C | 109.5 |
| P2—Pd2—Pd1 | 130.03 (4) | H53A—C53—H53C | 109.5 |
| Cl1—Pd2—Pd1 | 54.67 (3) | H53B—C53—H53C | 109.5 |
| Cl4—Pd2—Pd1 | 126.13 (4) | C56—C55—C57 | 111.5 (5) |
| C14—Pd3—P3 | 92.96 (16) | C56—C55—P4 | 110.9 (4) |
| C14—Pd3—Cl2 | 83.43 (15) | C57—C55—P4 | 109.9 (4) |
| P3—Pd3—Cl2 | 168.52 (6) | C56—C55—H55 | 108.2 |
| C14—Pd3—Cl3 | 171.08 (16) | C57—C55—H55 | 108.2 |
| P3—Pd3—Cl3 | 95.94 (5) | P4—C55—H55 | 108.2 |
| Cl2—Pd3—Cl3 | 87.73 (5) | C55—C56—H56A | 109.5 |
| C14—Pd3—Pd4 | 45.81 (15) | C55—C56—H56B | 109.5 |
| P3—Pd3—Pd4 | 128.42 (4) | H56A—C56—H56B | 109.5 |
| Cl2—Pd3—Pd4 | 55.00 (3) | C55—C56—H56C | 109.5 |
| Cl3—Pd3—Pd4 | 126.99 (3) | H56A—C56—H56C | 109.5 |
| C14—Pd4—P4 | 93.15 (15) | H56B—C56—H56C | 109.5 |
| C14—Pd4—Cl2 | 82.81 (15) | C55—C57—H57A | 109.5 |
| P4—Pd4—Cl2 | 165.38 (6) | C55—C57—H57B | 109.5 |
| C14—Pd4—Cl4 | 171.78 (15) | H57A—C57—H57B | 109.5 |
| P4—Pd4—Cl4 | 94.75 (5) | C55—C57—H57C | 109.5 |
| Cl2—Pd4—Cl4 | 90.06 (5) | H57A—C57—H57C | 109.5 |
| C14—Pd4—Pd3 | 45.46 (15) | H57B—C57—H57C | 109.5 |
| P4—Pd4—Pd3 | 130.09 (4) | C62—C61—C77 | 117.8 (5) |
| Cl2—Pd4—Pd3 | 54.52 (3) | C62—C61—P3 | 115.2 (4) |
| Cl4—Pd4—Pd3 | 126.60 (4) | C77—C61—P3 | 126.2 (4) |
| Pd1—Cl1—Pd2 | 70.30 (4) | C63—C62—C61 | 122.9 (5) |
| Pd3—Cl2—Pd4 | 70.48 (4) | C63—C62—H62 | 118.5 |
| Pd1—Cl3—Pd3 | 105.30 (5) | C61—C62—H62 | 118.5 |
| Pd2—Cl4—Pd4 | 106.56 (5) | C64—C63—C62 | 119.0 (5) |
| Pd1—C13—Pd2 | 88.4 (2) | C64—C63—H63 | 120.5 |
| Pd1—C13—H13A | 106 (3) | C62—C63—H63 | 120.5 |
| Pd2—C13—H13A | 108 (3) | C78—C64—C63 | 119.1 (5) |
| Pd1—C13—H13B | 121 (3) | C78—C64—H64 | 120.4 |
| Pd2—C13—H13B | 121 (3) | C63—C64—H64 | 120.4 |
| H13A—C13—H13B | 110 (4) | C66—C65—C80 | 118.6 (5) |
| Pd3—C14—Pd4 | 88.7 (2) | C66—C65—H65 | 120.7 |
| Pd3—C14—H14A | 120 (3) | C80—C65—H65 | 120.7 |
| Pd4—C14—H14A | 116 (3) | C67—C66—C65 | 120.6 (5) |
| Pd3—C14—H14B | 105 (3) | C67—C66—H66 | 119.7 |
| Pd4—C14—H14B | 110 (3) | C65—C66—H66 | 119.7 |
| H14A—C14—H14B | 114 (4) | C66—C67—C68 | 122.0 (5) |
| C21—P1—C1 | 101.1 (2) | C66—C67—H67 | 119.0 |
| C21—P1—C31 | 105.4 (3) | C68—C67—H67 | 119.0 |
| C1—P1—C31 | 105.2 (2) | C79—C68—C67 | 117.6 (5) |
| C21—P1—Pd1 | 110.04 (17) | C79—C68—P4 | 124.9 (4) |
| C1—P1—Pd1 | 126.30 (17) | C67—C68—P4 | 116.7 (4) |
| C31—P1—Pd1 | 107.06 (18) | C79—C69—C77 | 107.3 (4) |
| C8—P2—C51 | 106.0 (2) | C79—C69—C72 | 107.9 (4) |
| C8—P2—C41 | 101.1 (2) | C77—C69—C72 | 105.3 (4) |
| C51—P2—C41 | 103.6 (2) | C79—C69—H69 | 112.0 |
| C8—P2—Pd2 | 124.66 (17) | C77—C69—H69 | 112.0 |
| C51—P2—Pd2 | 107.31 (18) | C72—C69—H69 | 112.0 |
| C41—P2—Pd2 | 112.23 (17) | C80—C70—C78 | 105.5 (4) |
| C25—P3—C61 | 101.7 (2) | C80—C70—C71 | 108.2 (5) |
| C25—P3—C35 | 105.2 (2) | C78—C70—C71 | 108.1 (4) |
| C61—P3—C35 | 104.6 (2) | C80—C70—H70 | 111.6 |
| C25—P3—Pd3 | 109.80 (17) | C78—C70—H70 | 111.6 |
| C61—P3—Pd3 | 126.43 (16) | C71—C70—H70 | 111.6 |
| C35—P3—Pd3 | 107.38 (18) | C70—C71—C72 | 109.1 (4) |
| C68—P4—C45 | 101.5 (2) | C70—C71—H71A | 109.9 |
| C68—P4—C55 | 105.9 (2) | C72—C71—H71A | 109.9 |
| C45—P4—C55 | 104.2 (3) | C70—C71—H71B | 109.9 |
| C68—P4—Pd4 | 124.74 (17) | C72—C71—H71B | 109.9 |
| C45—P4—Pd4 | 111.81 (18) | H71A—C71—H71B | 108.3 |
| C55—P4—Pd4 | 106.91 (18) | C71—C72—C69 | 110.3 (4) |
| C2—C1—C17 | 117.0 (5) | C71—C72—H72A | 109.6 |
| C2—C1—P1 | 115.6 (4) | C69—C72—H72A | 109.6 |
| C17—C1—P1 | 126.8 (4) | C71—C72—H72B | 109.6 |
| C3—C2—C1 | 122.7 (5) | C69—C72—H72B | 109.6 |
| C3—C2—H2 | 118.6 | H72A—C72—H72B | 108.1 |
| C1—C2—H2 | 118.6 | C78—C77—C61 | 117.8 (5) |
| C4—C3—C2 | 120.5 (5) | C78—C77—C69 | 111.9 (4) |
| C4—C3—H3 | 119.8 | C61—C77—C69 | 130.3 (4) |
| C2—C3—H3 | 119.8 | C64—C78—C77 | 123.1 (5) |
| C3—C4—C18 | 117.9 (5) | C64—C78—C70 | 123.4 (5) |
| C3—C4—H4 | 121.1 | C77—C78—C70 | 113.4 (5) |
| C18—C4—H4 | 121.1 | C68—C79—C80 | 119.4 (5) |
| C20—C5—C6 | 118.7 (5) | C68—C79—C69 | 130.0 (4) |
| C20—C5—H5 | 120.6 | C80—C79—C69 | 110.6 (5) |
| C6—C5—H5 | 120.6 | C65—C80—C79 | 121.4 (5) |
| C7—C6—C5 | 119.4 (5) | C65—C80—C70 | 123.3 (5) |
| C7—C6—H6 | 120.3 | C79—C80—C70 | 115.3 (5) |
| C5—C6—H6 | 120.3 | C84—O80—C81 | 107.5 (6) |
| C6—C7—C8 | 123.0 (5) | O80—C81—C82 | 108.9 (6) |
| C6—C7—H7 | 118.5 | O80—C81—H81A | 109.9 |
| C8—C7—H7 | 118.5 | C82—C81—H81A | 109.9 |
| C19—C8—C7 | 117.6 (5) | O80—C81—H81B | 109.9 |
| C19—C8—P2 | 124.7 (4) | C82—C81—H81B | 109.9 |
| C7—C8—P2 | 116.7 (4) | H81A—C81—H81B | 108.3 |
| C17—C9—C12 | 107.1 (4) | C81—C82—C83 | 101.9 (6) |
| C17—C9—C19 | 105.5 (4) | C81—C82—H82A | 111.4 |
| C12—C9—C19 | 107.9 (4) | C83—C82—H82A | 111.4 |
| C17—C9—H9 | 112.0 | C81—C82—H82B | 111.4 |
| C12—C9—H9 | 112.0 | C83—C82—H82B | 111.4 |
| C19—C9—H9 | 112.0 | H82A—C82—H82B | 109.2 |
| C20—C10—C18 | 105.0 (4) | C84—C83—C82 | 102.3 (6) |
| C20—C10—C11 | 108.4 (4) | C84—C83—H83A | 111.3 |
| C18—C10—C11 | 108.5 (4) | C82—C83—H83A | 111.3 |
| C20—C10—H10 | 111.5 | C84—C83—H83B | 111.3 |
| C18—C10—H10 | 111.5 | C82—C83—H83B | 111.3 |
| C11—C10—H10 | 111.5 | H83A—C83—H83B | 109.2 |
| C12—C11—C10 | 109.0 (4) | O80—C84—C83 | 107.8 (6) |
| C12—C11—H11A | 109.9 | O80—C84—H84A | 110.1 |
| C10—C11—H11A | 109.9 | C83—C84—H84A | 110.1 |
| C12—C11—H11B | 109.9 | O80—C84—H84B | 110.1 |
| C10—C11—H11B | 109.9 | C83—C84—H84B | 110.1 |
| H11A—C11—H11B | 108.3 | H84A—C84—H84B | 108.5 |
| C9—C12—C11 | 110.4 (4) | C86—O85—C89 | 108.4 (6) |
| C9—C12—H12A | 109.6 | O85—C86—C87 | 107.0 (6) |
| C11—C12—H12A | 109.6 | O85—C86—H86A | 110.3 |
| C9—C12—H12B | 109.6 | C87—C86—H86A | 110.3 |
| C11—C12—H12B | 109.6 | O85—C86—H86B | 110.3 |
| H12A—C12—H12B | 108.1 | C87—C86—H86B | 110.3 |
| C1—C17—C18 | 119.1 (4) | H86A—C86—H86B | 108.6 |
| C1—C17—C9 | 129.5 (4) | C88—C87—C86 | 103.1 (6) |
| C18—C17—C9 | 111.4 (4) | C88—C87—H87A | 111.1 |
| C4—C18—C17 | 122.6 (5) | C86—C87—H87A | 111.1 |
| C4—C18—C10 | 123.1 (5) | C88—C87—H87B | 111.1 |
| C17—C18—C10 | 114.2 (4) | C86—C87—H87B | 111.1 |
| C8—C19—C20 | 118.7 (5) | H87A—C87—H87B | 109.1 |
| C8—C19—C9 | 129.7 (4) | C89—C88—C87 | 101.5 (6) |
| C20—C19—C9 | 111.6 (4) | C89—C88—H88A | 111.5 |
| C5—C20—C19 | 122.1 (5) | C87—C88—H88A | 111.5 |
| C5—C20—C10 | 123.9 (5) | C89—C88—H88B | 111.5 |
| C19—C20—C10 | 113.9 (5) | C87—C88—H88B | 111.5 |
| C22—C21—C23 | 111.5 (5) | H88A—C88—H88B | 109.3 |
| C22—C21—P1 | 109.1 (4) | O85—C89—C88 | 105.8 (6) |
| C23—C21—P1 | 116.8 (4) | O85—C89—H89A | 110.6 |
| C22—C21—H21 | 106.3 | C88—C89—H89A | 110.6 |
| C23—C21—H21 | 106.3 | O85—C89—H89B | 110.6 |
| P1—C21—H21 | 106.3 | C88—C89—H89B | 110.6 |
| C21—C22—H22A | 109.5 | H89A—C89—H89B | 108.7 |
| C21—C22—H22B | 109.5 | C94—O90—C91 | 106.6 (8) |
| H22A—C22—H22B | 109.5 | O90—C91—C92 | 111.8 (8) |
| C21—C22—H22C | 109.5 | O90—C91—H91A | 109.3 |
| H22A—C22—H22C | 109.5 | C92—C91—H91A | 109.3 |
| H22B—C22—H22C | 109.5 | O90—C91—H91B | 109.3 |
| C21—C23—H23A | 109.5 | C92—C91—H91B | 109.3 |
| C21—C23—H23B | 109.5 | H91A—C91—H91B | 107.9 |
| H23A—C23—H23B | 109.5 | C91—C92—C93 | 102.1 (7) |
| C21—C23—H23C | 109.5 | C91—C92—H92A | 111.3 |
| H23A—C23—H23C | 109.5 | C93—C92—H92A | 111.3 |
| H23B—C23—H23C | 109.5 | C91—C92—H92B | 111.3 |
| C26—C25—C27 | 111.3 (5) | C93—C92—H92B | 111.3 |
| C26—C25—P3 | 110.2 (4) | H92A—C92—H92B | 109.2 |
| C27—C25—P3 | 116.7 (4) | C94—C93—C92 | 104.3 (7) |
| C26—C25—H25 | 106.0 | C94—C93—H93A | 110.9 |
| C27—C25—H25 | 106.0 | C92—C93—H93A | 110.9 |
| P3—C25—H25 | 106.0 | C94—C93—H93B | 110.9 |
| C25—C26—H26A | 109.5 | C92—C93—H93B | 110.9 |
| C25—C26—H26B | 109.5 | H93A—C93—H93B | 108.9 |
| H26A—C26—H26B | 109.5 | O90—C94—C93 | 110.4 (8) |
| C25—C26—H26C | 109.5 | O90—C94—H94A | 109.6 |
| H26A—C26—H26C | 109.5 | C93—C94—H94A | 109.6 |
| H26B—C26—H26C | 109.5 | O90—C94—H94B | 109.6 |
| C25—C27—H27A | 109.5 | C93—C94—H94B | 109.6 |
| C25—C27—H27B | 109.5 | H94A—C94—H94B | 108.1 |
| H27A—C27—H27B | 109.5 | C96—O95—C99 | 108.5 (11) |
| C25—C27—H27C | 109.5 | O95—C96—C97 | 108.8 (12) |
| H27A—C27—H27C | 109.5 | O95—C96—H96A | 109.9 |
| H27B—C27—H27C | 109.5 | C97—C96—H96A | 109.9 |
| C32—C31—C33 | 111.6 (5) | O95—C96—H96B | 109.9 |
| C32—C31—P1 | 110.6 (4) | C97—C96—H96B | 109.9 |
| C33—C31—P1 | 110.1 (4) | H96A—C96—H96B | 108.3 |
| C32—C31—H31 | 108.2 | C96—C97—C98 | 103.2 (12) |
| C33—C31—H31 | 108.2 | C96—C97—H97A | 111.1 |
| P1—C31—H31 | 108.2 | C98—C97—H97A | 111.1 |
| C31—C32—H32A | 109.5 | C96—C97—H97B | 111.1 |
| C31—C32—H32B | 109.5 | C98—C97—H97B | 111.1 |
| H32A—C32—H32B | 109.5 | H97A—C97—H97B | 109.1 |
| C31—C32—H32C | 109.5 | C99—C98—C97 | 106.3 (11) |
| H32A—C32—H32C | 109.5 | C99—C98—H98A | 110.5 |
| H32B—C32—H32C | 109.5 | C97—C98—H98A | 110.5 |
| C31—C33—H33A | 109.5 | C99—C98—H98B | 110.5 |
| C31—C33—H33B | 109.5 | C97—C98—H98B | 110.5 |
| H33A—C33—H33B | 109.5 | H98A—C98—H98B | 108.7 |
| C31—C33—H33C | 109.5 | O95—C99—C98 | 108.6 (11) |
| H33A—C33—H33C | 109.5 | O95—C99—H99A | 110.0 |
| H33B—C33—H33C | 109.5 | C98—C99—H99A | 110.0 |
| C37—C35—C36 | 111.8 (5) | O95—C99—H99B | 110.0 |
| C37—C35—P3 | 110.0 (4) | C98—C99—H99B | 110.0 |
| C36—C35—P3 | 110.2 (4) | H99A—C99—H99B | 108.4 |
| C37—C35—H35 | 108.2 | C99B—O95B—C96B | 108.7 (10) |
| C36—C35—H35 | 108.2 | O95B—C96B—C97B | 106.9 (10) |
| P3—C35—H35 | 108.2 | O95B—C96B—H96C | 110.3 |
| C35—C36—H36A | 109.5 | C97B—C96B—H96C | 110.3 |
| C35—C36—H36B | 109.5 | O95B—C96B—H96D | 110.3 |
| H36A—C36—H36B | 109.5 | C97B—C96B—H96D | 110.3 |
| C35—C36—H36C | 109.5 | H96C—C96B—H96D | 108.6 |
| H36A—C36—H36C | 109.5 | C96B—C97B—C98B | 105.2 (10) |
| H36B—C36—H36C | 109.5 | C96B—C97B—H97C | 110.7 |
| C35—C37—H37A | 109.5 | C98B—C97B—H97C | 110.7 |
| C35—C37—H37B | 109.5 | C96B—C97B—H97D | 110.7 |
| H37A—C37—H37B | 109.5 | C98B—C97B—H97D | 110.7 |
| C35—C37—H37C | 109.5 | H97C—C97B—H97D | 108.8 |
| H37A—C37—H37C | 109.5 | C99B—C98B—C97B | 103.5 (10) |
| H37B—C37—H37C | 109.5 | C99B—C98B—H98C | 111.1 |
| C42—C41—C43 | 110.8 (5) | C97B—C98B—H98C | 111.1 |
| C42—C41—P2 | 110.6 (4) | C99B—C98B—H98D | 111.1 |
| C43—C41—P2 | 115.4 (4) | C97B—C98B—H98D | 111.1 |
| C42—C41—H41 | 106.5 | H98C—C98B—H98D | 109.0 |
| C43—C41—H41 | 106.5 | O95B—C99B—C98B | 105.4 (11) |
| P2—C41—H41 | 106.5 | O95B—C99B—H99C | 110.7 |
| C41—C42—H42A | 109.5 | C98B—C99B—H99C | 110.7 |
| C41—C42—H42B | 109.5 | O95B—C99B—H99D | 110.7 |
| H42A—C42—H42B | 109.5 | C98B—C99B—H99D | 110.7 |
| C41—C42—H42C | 109.5 | H99C—C99B—H99D | 108.8 |
| H42A—C42—H42C | 109.5 | C101—O100—C104 | 109.5 (6) |
| H42B—C42—H42C | 109.5 | O100—C101—C102 | 108.5 (6) |
| C41—C43—H43A | 109.5 | O100—C101—H10A | 110.0 |
| C41—C43—H43B | 109.5 | C102—C101—H10A | 110.0 |
| H43A—C43—H43B | 109.5 | O100—C101—H10B | 110.0 |
| C41—C43—H43C | 109.5 | C102—C101—H10B | 110.0 |
| H43A—C43—H43C | 109.5 | H10A—C101—H10B | 108.4 |
| H43B—C43—H43C | 109.5 | C101—C102—C103 | 106.3 (6) |
| C46—C45—C47 | 110.6 (5) | C101—C102—H10C | 110.5 |
| C46—C45—P4 | 110.1 (4) | C103—C102—H10C | 110.5 |
| C47—C45—P4 | 115.7 (4) | C101—C102—H10D | 110.5 |
| C46—C45—H45 | 106.6 | C103—C102—H10D | 110.5 |
| C47—C45—H45 | 106.6 | H10C—C102—H10D | 108.7 |
| P4—C45—H45 | 106.6 | C104—C103—C102 | 105.8 (6) |
| C45—C46—H46A | 109.5 | C104—C103—H10E | 110.6 |
| C45—C46—H46B | 109.5 | C102—C103—H10E | 110.6 |
| H46A—C46—H46B | 109.5 | C104—C103—H10F | 110.6 |
| C45—C46—H46C | 109.5 | C102—C103—H10F | 110.6 |
| H46A—C46—H46C | 109.5 | H10E—C103—H10F | 108.7 |
| H46B—C46—H46C | 109.5 | O100—C104—C103 | 108.9 (6) |
| C45—C47—H47A | 109.5 | O100—C104—H10G | 109.9 |
| C45—C47—H47B | 109.5 | C103—C104—H10G | 109.9 |
| H47A—C47—H47B | 109.5 | O100—C104—H10H | 109.9 |
| C45—C47—H47C | 109.5 | C103—C104—H10H | 109.9 |
| H47A—C47—H47C | 109.5 | H10G—C104—H10H | 108.3 |
| P1—Pd1—Pd2—C13 | −48.2 (2) | C11—C10—C18—C17 | −58.7 (6) |
| Cl1—Pd1—Pd2—C13 | 118.6 (2) | C7—C8—C19—C20 | −7.6 (7) |
| Cl3—Pd1—Pd2—C13 | 173.1 (2) | P2—C8—C19—C20 | 160.4 (4) |
| C13—Pd1—Pd2—P2 | 41.6 (2) | C7—C8—C19—C9 | 172.3 (5) |
| P1—Pd1—Pd2—P2 | −6.58 (8) | P2—C8—C19—C9 | −19.7 (8) |
| Cl1—Pd1—Pd2—P2 | 160.23 (7) | C17—C9—C19—C8 | −124.8 (5) |
| Cl3—Pd1—Pd2—P2 | −145.33 (7) | C12—C9—C19—C8 | 120.9 (5) |
| C13—Pd1—Pd2—Cl1 | −118.6 (2) | C17—C9—C19—C20 | 55.1 (5) |
| P1—Pd1—Pd2—Cl1 | −166.80 (7) | C12—C9—C19—C20 | −59.2 (5) |
| Cl3—Pd1—Pd2—Cl1 | 54.44 (6) | C6—C5—C20—C19 | 1.6 (8) |
| C13—Pd1—Pd2—Cl4 | −179.0 (2) | C6—C5—C20—C10 | −175.2 (5) |
| P1—Pd1—Pd2—Cl4 | 132.84 (7) | C8—C19—C20—C5 | 4.9 (8) |
| Cl1—Pd1—Pd2—Cl4 | −60.35 (7) | C9—C19—C20—C5 | −175.0 (5) |
| Cl3—Pd1—Pd2—Cl4 | −5.91 (7) | C8—C19—C20—C10 | −178.0 (4) |
| P3—Pd3—Pd4—C14 | −47.2 (2) | C9—C19—C20—C10 | 2.1 (6) |
| Cl2—Pd3—Pd4—C14 | 119.1 (2) | C18—C10—C20—C5 | 118.9 (6) |
| Cl3—Pd3—Pd4—C14 | 173.1 (2) | C11—C10—C20—C5 | −125.3 (6) |
| C14—Pd3—Pd4—P4 | 43.3 (2) | C18—C10—C20—C19 | −58.1 (6) |
| P3—Pd3—Pd4—P4 | −3.91 (8) | C11—C10—C20—C19 | 57.7 (6) |
| Cl2—Pd3—Pd4—P4 | 162.40 (7) | C1—P1—C21—C22 | −66.9 (4) |
| Cl3—Pd3—Pd4—P4 | −143.62 (7) | C31—P1—C21—C22 | −176.2 (4) |
| C14—Pd3—Pd4—Cl2 | −119.1 (2) | Pd1—P1—C21—C22 | 68.7 (4) |
| P3—Pd3—Pd4—Cl2 | −166.31 (7) | C1—P1—C21—C23 | 60.6 (5) |
| Cl3—Pd3—Pd4—Cl2 | 53.98 (7) | C31—P1—C21—C23 | −48.7 (5) |
| C14—Pd3—Pd4—Cl4 | −177.2 (2) | Pd1—P1—C21—C23 | −163.8 (4) |
| P3—Pd3—Pd4—Cl4 | 135.55 (7) | C61—P3—C25—C26 | −67.4 (4) |
| Cl2—Pd3—Pd4—Cl4 | −58.15 (8) | C35—P3—C25—C26 | −176.2 (4) |
| Cl3—Pd3—Pd4—Cl4 | −4.16 (8) | Pd3—P3—C25—C26 | 68.6 (4) |
| C13—Pd1—Cl1—Pd2 | 39.34 (16) | C61—P3—C25—C27 | 60.7 (4) |
| P1—Pd1—Cl1—Pd2 | 106.8 (3) | C35—P3—C25—C27 | −48.1 (5) |
| Cl3—Pd1—Cl1—Pd2 | −139.83 (5) | Pd3—P3—C25—C27 | −163.3 (4) |
| C13—Pd2—Cl1—Pd1 | −39.29 (16) | C21—P1—C31—C32 | 175.1 (4) |
| P2—Pd2—Cl1—Pd1 | −112.65 (17) | C1—P1—C31—C32 | 68.7 (4) |
| Cl4—Pd2—Cl1—Pd1 | 135.41 (5) | Pd1—P1—C31—C32 | −67.8 (4) |
| C14—Pd3—Cl2—Pd4 | 39.11 (16) | C21—P1—C31—C33 | −61.2 (4) |
| P3—Pd3—Cl2—Pd4 | 111.3 (2) | C1—P1—C31—C33 | −167.5 (4) |
| Cl3—Pd3—Cl2—Pd4 | −139.72 (5) | Pd1—P1—C31—C33 | 56.0 (4) |
| C14—Pd4—Cl2—Pd3 | −38.89 (15) | C25—P3—C35—C37 | −65.2 (5) |
| P4—Pd4—Cl2—Pd3 | −113.6 (2) | C61—P3—C35—C37 | −171.9 (4) |
| Cl4—Pd4—Cl2—Pd3 | 137.01 (5) | Pd3—P3—C35—C37 | 51.7 (5) |
| C13—Pd1—Cl3—Pd3 | 33.1 (12) | C25—P3—C35—C36 | 171.1 (4) |
| P1—Pd1—Cl3—Pd3 | −151.36 (6) | C61—P3—C35—C36 | 64.4 (4) |
| Cl1—Pd1—Cl3—Pd3 | 38.70 (6) | Pd3—P3—C35—C36 | −72.0 (4) |
| Pd2—Pd1—Cl3—Pd3 | −3.13 (7) | C8—P2—C41—C42 | 67.7 (4) |
| C14—Pd3—Cl3—Pd1 | 41.5 (10) | C51—P2—C41—C42 | 177.3 (4) |
| P3—Pd3—Cl3—Pd1 | −141.93 (6) | Pd2—P2—C41—C42 | −67.2 (4) |
| Cl2—Pd3—Cl3—Pd1 | 48.98 (6) | C8—P2—C41—C43 | −59.1 (5) |
| Pd4—Pd3—Cl3—Pd1 | 7.45 (7) | C51—P2—C41—C43 | 50.6 (5) |
| C13—Pd2—Cl4—Pd4 | 3.9 (12) | Pd2—P2—C41—C43 | 166.0 (4) |
| P2—Pd2—Cl4—Pd4 | 158.94 (7) | C68—P4—C45—C46 | 68.6 (4) |
| Cl1—Pd2—Cl4—Pd4 | −36.21 (7) | C55—P4—C45—C46 | 178.4 (4) |
| Pd1—Pd2—Cl4—Pd4 | 8.95 (9) | Pd4—P4—C45—C46 | −66.4 (4) |
| C14—Pd4—Cl4—Pd2 | −18.7 (11) | C68—P4—C45—C47 | −57.7 (5) |
| P4—Pd4—Cl4—Pd2 | 145.37 (7) | C55—P4—C45—C47 | 52.2 (5) |
| Cl2—Pd4—Cl4—Pd2 | −48.46 (7) | Pd4—P4—C45—C47 | 167.3 (4) |
| Pd3—Pd4—Cl4—Pd2 | −4.70 (9) | C8—P2—C51—C53 | 172.1 (4) |
| P1—Pd1—C13—Pd2 | 143.68 (16) | C41—P2—C51—C53 | 66.1 (4) |
| Cl1—Pd1—C13—Pd2 | −46.40 (15) | Pd2—P2—C51—C53 | −52.8 (4) |
| Cl3—Pd1—C13—Pd2 | −40.7 (13) | C8—P2—C51—C52 | −65.1 (4) |
| P2—Pd2—C13—Pd1 | −149.43 (16) | C41—P2—C51—C52 | −171.1 (4) |
| Cl1—Pd2—C13—Pd1 | 46.18 (15) | Pd2—P2—C51—C52 | 70.0 (4) |
| Cl4—Pd2—C13—Pd1 | 5.7 (13) | C68—P4—C55—C56 | −67.6 (4) |
| P3—Pd3—C14—Pd4 | 144.83 (15) | C45—P4—C55—C56 | −174.2 (4) |
| Cl2—Pd3—C14—Pd4 | −46.11 (14) | Pd4—P4—C55—C56 | 67.2 (4) |
| Cl3—Pd3—C14—Pd4 | −38.6 (11) | C68—P4—C55—C57 | 168.6 (4) |
| P4—Pd4—C14—Pd3 | −148.28 (15) | C45—P4—C55—C57 | 62.1 (5) |
| Cl2—Pd4—C14—Pd3 | 45.84 (14) | Pd4—P4—C55—C57 | −56.5 (4) |
| Cl4—Pd4—C14—Pd3 | 15.8 (12) | C25—P3—C61—C62 | −73.1 (4) |
| C13—Pd1—P1—C21 | −158.8 (3) | C35—P3—C61—C62 | 36.1 (5) |
| Cl1—Pd1—P1—C21 | 134.6 (3) | Pd3—P3—C61—C62 | 161.2 (3) |
| Cl3—Pd1—P1—C21 | 21.9 (2) | C25—P3—C61—C77 | 96.6 (5) |
| Pd2—Pd1—P1—C21 | −126.45 (19) | C35—P3—C61—C77 | −154.1 (4) |
| C13—Pd1—P1—C1 | −37.3 (3) | Pd3—P3—C61—C77 | −29.0 (5) |
| Cl1—Pd1—P1—C1 | −103.9 (3) | C77—C61—C62—C63 | −2.5 (8) |
| Cl3—Pd1—P1—C1 | 143.3 (2) | P3—C61—C62—C63 | 168.2 (5) |
| Pd2—Pd1—P1—C1 | −5.0 (2) | C61—C62—C63—C64 | −0.5 (9) |
| C13—Pd1—P1—C31 | 87.2 (2) | C62—C63—C64—C78 | 2.2 (8) |
| Cl1—Pd1—P1—C31 | 20.6 (3) | C80—C65—C66—C67 | −4.3 (9) |
| Cl3—Pd1—P1—C31 | −92.19 (19) | C65—C66—C67—C68 | 2.3 (9) |
| Pd2—Pd1—P1—C31 | 119.51 (19) | C66—C67—C68—C79 | 3.4 (8) |
| C13—Pd2—P2—C8 | 37.3 (3) | C66—C67—C68—P4 | −166.7 (5) |
| Cl1—Pd2—P2—C8 | 109.4 (3) | C45—P4—C68—C79 | −90.5 (5) |
| Cl4—Pd2—P2—C8 | −139.2 (2) | C55—P4—C68—C79 | 160.9 (4) |
| Pd1—Pd2—P2—C8 | 8.9 (2) | Pd4—P4—C68—C79 | 36.5 (5) |
| C13—Pd2—P2—C51 | −87.2 (2) | C45—P4—C68—C67 | 78.7 (4) |
| Cl1—Pd2—P2—C51 | −15.1 (3) | C55—P4—C68—C67 | −29.8 (5) |
| Cl4—Pd2—P2—C51 | 96.27 (18) | Pd4—P4—C68—C67 | −154.2 (3) |
| Pd1—Pd2—P2—C51 | −115.58 (18) | C80—C70—C71—C72 | −58.2 (6) |
| C13—Pd2—P2—C41 | 159.7 (2) | C78—C70—C71—C72 | 55.6 (6) |
| Cl1—Pd2—P2—C41 | −128.2 (2) | C70—C71—C72—C69 | 3.4 (6) |
| Cl4—Pd2—P2—C41 | −16.86 (19) | C79—C69—C72—C71 | 54.6 (6) |
| Pd1—Pd2—P2—C41 | 131.30 (19) | C77—C69—C72—C71 | −59.8 (5) |
| C14—Pd3—P3—C25 | −158.6 (2) | C62—C61—C77—C78 | 3.6 (7) |
| Cl2—Pd3—P3—C25 | 130.1 (3) | P3—C61—C77—C78 | −165.9 (4) |
| Cl3—Pd3—P3—C25 | 21.90 (18) | C62—C61—C77—C69 | −176.4 (5) |
| Pd4—Pd3—P3—C25 | −126.81 (18) | P3—C61—C77—C69 | 14.1 (8) |
| C14—Pd3—P3—C61 | −36.4 (3) | C79—C69—C77—C78 | −55.4 (5) |
| Cl2—Pd3—P3—C61 | −107.7 (3) | C72—C69—C77—C78 | 59.4 (5) |
| Cl3—Pd3—P3—C61 | 144.1 (2) | C79—C69—C77—C61 | 124.6 (5) |
| Pd4—Pd3—P3—C61 | −4.6 (2) | C72—C69—C77—C61 | −120.6 (5) |
| C14—Pd3—P3—C35 | 87.5 (2) | C63—C64—C78—C77 | −1.0 (8) |
| Cl2—Pd3—P3—C35 | 16.2 (3) | C63—C64—C78—C70 | 177.0 (5) |
| Cl3—Pd3—P3—C35 | −91.94 (19) | C61—C77—C78—C64 | −2.0 (8) |
| Pd4—Pd3—P3—C35 | 119.34 (18) | C69—C77—C78—C64 | 178.0 (5) |
| C14—Pd4—P4—C68 | 34.1 (3) | C61—C77—C78—C70 | 179.8 (4) |
| Cl2—Pd4—P4—C68 | 107.5 (3) | C69—C77—C78—C70 | −0.2 (6) |
| Cl4—Pd4—P4—C68 | −143.6 (2) | C80—C70—C78—C64 | −122.2 (6) |
| Pd3—Pd4—P4—C68 | 4.8 (2) | C71—C70—C78—C64 | 122.2 (6) |
| C14—Pd4—P4—C45 | 156.7 (3) | C80—C70—C78—C77 | 56.0 (6) |
| Cl2—Pd4—P4—C45 | −129.9 (3) | C71—C70—C78—C77 | −59.6 (6) |
| Cl4—Pd4—P4—C45 | −21.0 (2) | C67—C68—C79—C80 | −6.9 (7) |
| Pd3—Pd4—P4—C45 | 127.4 (2) | P4—C68—C79—C80 | 162.2 (4) |
| C14—Pd4—P4—C55 | −89.8 (2) | C67—C68—C79—C69 | 172.2 (5) |
| Cl2—Pd4—P4—C55 | −16.4 (3) | P4—C68—C79—C69 | −18.6 (8) |
| Cl4—Pd4—P4—C55 | 92.41 (19) | C77—C69—C79—C68 | −126.1 (6) |
| Pd3—Pd4—P4—C55 | −119.16 (19) | C72—C69—C79—C68 | 120.9 (6) |
| C21—P1—C1—C2 | −75.0 (4) | C77—C69—C79—C80 | 53.1 (5) |
| C31—P1—C1—C2 | 34.5 (5) | C72—C69—C79—C80 | −59.9 (6) |
| Pd1—P1—C1—C2 | 159.7 (3) | C66—C65—C80—C79 | 0.5 (9) |
| C21—P1—C1—C17 | 95.5 (5) | C66—C65—C80—C70 | −177.1 (5) |
| C31—P1—C1—C17 | −155.0 (5) | C68—C79—C80—C65 | 5.2 (8) |
| Pd1—P1—C1—C17 | −29.8 (5) | C69—C79—C80—C65 | −174.2 (5) |
| C17—C1—C2—C3 | −4.0 (8) | C68—C79—C80—C70 | −177.0 (5) |
| P1—C1—C2—C3 | 167.4 (4) | C69—C79—C80—C70 | 3.6 (7) |
| C1—C2—C3—C4 | −0.5 (9) | C78—C70—C80—C65 | 119.0 (6) |
| C2—C3—C4—C18 | 3.5 (8) | C71—C70—C80—C65 | −125.5 (6) |
| C20—C5—C6—C7 | −5.1 (8) | C78—C70—C80—C79 | −58.8 (6) |
| C5—C6—C7—C8 | 2.2 (9) | C71—C70—C80—C79 | 56.7 (6) |
| C6—C7—C8—C19 | 4.2 (8) | C84—O80—C81—C82 | 5.0 (9) |
| C6—C7—C8—P2 | −164.8 (4) | O80—C81—C82—C83 | −24.0 (9) |
| C51—P2—C8—C19 | 160.6 (4) | C81—C82—C83—C84 | 32.6 (8) |
| C41—P2—C8—C19 | −91.7 (5) | C81—O80—C84—C83 | 16.9 (9) |
| Pd2—P2—C8—C19 | 35.5 (5) | C82—C83—C84—O80 | −31.4 (8) |
| C51—P2—C8—C7 | −31.3 (5) | C89—O85—C86—C87 | −4.0 (12) |
| C41—P2—C8—C7 | 76.4 (4) | O85—C86—C87—C88 | −19.3 (11) |
| Pd2—P2—C8—C7 | −156.4 (3) | C86—C87—C88—C89 | 33.6 (10) |
| C20—C10—C11—C12 | −58.4 (6) | C86—O85—C89—C88 | 26.2 (11) |
| C18—C10—C11—C12 | 55.2 (6) | C87—C88—C89—O85 | −37.3 (9) |
| C17—C9—C12—C11 | −58.4 (5) | C94—O90—C91—C92 | 2.7 (16) |
| C19—C9—C12—C11 | 54.8 (5) | O90—C91—C92—C93 | −15.2 (15) |
| C10—C11—C12—C9 | 2.3 (6) | C91—C92—C93—C94 | 20.8 (12) |
| C2—C1—C17—C18 | 5.4 (7) | C91—O90—C94—C93 | 11.8 (14) |
| P1—C1—C17—C18 | −165.0 (4) | C92—C93—C94—O90 | −21.1 (13) |
| C2—C1—C17—C9 | −174.2 (5) | C99—O95—C96—C97 | 22 (4) |
| P1—C1—C17—C9 | 15.4 (8) | O95—C96—C97—C98 | −20 (4) |
| C12—C9—C17—C1 | −121.6 (6) | C96—C97—C98—C99 | 11 (4) |
| C19—C9—C17—C1 | 123.6 (5) | C96—O95—C99—C98 | −15 (3) |
| C12—C9—C17—C18 | 58.7 (5) | C97—C98—C99—O95 | 2(4) |
| C19—C9—C17—C18 | −56.0 (5) | C99B—O95B—C96B—C97B | −21 (3) |
| C3—C4—C18—C17 | −2.0 (8) | O95B—C96B—C97B—C98B | 1(3) |
| C3—C4—C18—C10 | 174.8 (5) | C96B—C97B—C98B—C99B | 17 (3) |
| C1—C17—C18—C4 | −2.5 (8) | C96B—O95B—C99B—C98B | 32 (2) |
| C9—C17—C18—C4 | 177.2 (5) | C97B—C98B—C99B—O95B | −30 (3) |
| C1—C17—C18—C10 | −179.6 (4) | C104—O100—C101—C102 | −7.5 (10) |
| C9—C17—C18—C10 | 0.1 (6) | O100—C101—C102—C103 | 1.9 (11) |
| C20—C10—C18—C4 | −120.0 (5) | C101—C102—C103—C104 | 4.1 (12) |
| C11—C10—C18—C4 | 124.3 (5) | C101—O100—C104—C103 | 10.3 (11) |
| C20—C10—C18—C17 | 57.1 (6) | C102—C103—C104—O100 | −8.7 (12) |