| Literature DB >> 21522851 |
Omar Bin Shawkataly, Imthyaz Ahmed Khan, Siti Syaida Sirat, Chin Sing Yeap, Hoong-Kun Fun.
Abstract
The asymmetric unit of the title triangulo-triruthenium compound, [Ru(3)(C(21)H(21)AsO(3))(C(26)H(24)P(2))(CO)(9)]·CHCl(3), consists of one mol-ecule of the triangulo-triruthenium complex and one chloro-form solvent mol-ecule. The bis(diphenyl-phosphan-yl)ethane ligand bridges an Ru-Ru bond and the monodentate arsane ligand bonds to the third Ru atom. Both the arsane and phosphine ligands are equatorial with respect to the Ru(3) triangle. Additionally, each Ru atom carries one equatorial and two axial terminal carbonyl ligands. The three arsane-substituted benzene rings make dihedral angles of 52.72 (19), 63.03 (19) and 88.19 (19)° with each other. The dihedral angles between the two benzene rings are 85.8 (2) and 89.2 (2)° for the two diphenyl-phosphanyl groups. In the crystal, mol-ecules are linked together into a three-dimensional network via inter-molecular C-H⋯O hydrogen bonds. Weak inter-molecular C-H⋯π inter-actions further stabilize the crystal structure.Entities:
Year: 2011 PMID: 21522851 PMCID: PMC3051462 DOI: 10.1107/S160053681100047X
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ru3(C21H21AsO3)(C26H24P2)(CO)9]·CHCl3 | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 9908 reflections |
| θ = 2.2–30.0° | |
| µ = 1.59 mm−1 | |
| β = 98.689 (1)° | Plate, brown |
| 0.58 × 0.26 × 0.04 mm | |
| Bruker SMART APEXII CCD area-detector diffractometer | 16965 independent reflections |
| Radiation source: fine-focus sealed tube | 12581 reflections with |
| graphite | |
| φ and ω scans | θmax = 30.1°, θmin = 1.9° |
| Absorption correction: multi-scan ( | |
| 64045 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-atom parameters constrained | |
| 16965 reflections | (Δ/σ)max < 0.001 |
| 706 parameters | Δρmax = 2.13 e Å−3 |
| 0 restraints | Δρmin = −1.16 e Å−3 |
| Experimental. The crystal was placed in the cold stream of an Oxford Cryosystems Cobra open-flow nitrogen cryostat (Cosier & Glazer, 1986) operating at 100.0 (1) K. |
| 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 |
| Ru1 | 0.32826 (2) | 0.210241 (17) | 0.048812 (14) | 0.01175 (8) | |
| Ru2 | 0.36871 (2) | 0.252908 (17) | 0.170465 (14) | 0.01048 (7) | |
| Ru3 | 0.16553 (2) | 0.216924 (17) | 0.120575 (14) | 0.01162 (8) | |
| As1 | −0.00362 (3) | 0.19620 (2) | 0.060148 (19) | 0.01228 (9) | |
| P1 | 0.47394 (8) | 0.25345 (6) | 0.01451 (5) | 0.0132 (2) | |
| P2 | 0.54788 (8) | 0.25502 (6) | 0.18788 (5) | 0.0119 (2) | |
| O1 | 0.4486 (2) | 0.08901 (16) | 0.10796 (14) | 0.0228 (7) | |
| O2 | 0.2482 (3) | 0.11519 (19) | −0.05325 (16) | 0.0355 (9) | |
| O3 | 0.2033 (2) | 0.33319 (16) | −0.00532 (14) | 0.0207 (7) | |
| O4 | 0.3584 (2) | 0.38885 (16) | 0.10400 (14) | 0.0220 (7) | |
| O5 | 0.3269 (3) | 0.31436 (17) | 0.28767 (14) | 0.0257 (8) | |
| O6 | 0.3642 (2) | 0.11144 (16) | 0.22650 (14) | 0.0220 (7) | |
| O7 | 0.2049 (2) | 0.06503 (16) | 0.10891 (14) | 0.0227 (7) | |
| O8 | 0.1159 (3) | 0.20591 (18) | 0.24703 (14) | 0.0290 (8) | |
| O9 | 0.1242 (2) | 0.37007 (17) | 0.11541 (16) | 0.0258 (8) | |
| O10 | 0.0087 (2) | 0.09243 (16) | −0.19322 (13) | 0.0188 (7) | |
| O11 | −0.2495 (2) | 0.45858 (16) | 0.04417 (14) | 0.0216 (7) | |
| O12 | −0.2560 (2) | −0.01650 (16) | 0.16866 (14) | 0.0203 (7) | |
| C1 | 0.5493 (3) | 0.1957 (2) | −0.02549 (18) | 0.0161 (9) | |
| C2 | 0.5315 (3) | 0.1269 (2) | −0.0287 (2) | 0.0204 (10) | |
| H2A | 0.4790 | 0.1087 | −0.0102 | 0.025* | |
| C3 | 0.5906 (4) | 0.0844 (3) | −0.0590 (2) | 0.0268 (11) | |
| H3A | 0.5781 | 0.0381 | −0.0601 | 0.032* | |
| C4 | 0.6673 (4) | 0.1106 (3) | −0.0874 (2) | 0.0267 (12) | |
| H4A | 0.7065 | 0.0822 | −0.1079 | 0.032* | |
| C5 | 0.6861 (4) | 0.1789 (3) | −0.0855 (2) | 0.0303 (12) | |
| H5A | 0.7378 | 0.1965 | −0.1050 | 0.036* | |
| C6 | 0.6287 (4) | 0.2218 (3) | −0.0549 (2) | 0.0250 (11) | |
| H6A | 0.6424 | 0.2679 | −0.0538 | 0.030* | |
| C7 | 0.4436 (3) | 0.3220 (2) | −0.03952 (18) | 0.0156 (9) | |
| C8 | 0.3745 (3) | 0.3076 (3) | −0.09188 (19) | 0.0226 (10) | |
| H8A | 0.3503 | 0.2638 | −0.0991 | 0.027* | |
| C9 | 0.3421 (4) | 0.3579 (3) | −0.1327 (2) | 0.0262 (11) | |
| H9A | 0.2968 | 0.3477 | −0.1673 | 0.031* | |
| C10 | 0.3765 (4) | 0.4235 (3) | −0.1224 (2) | 0.0291 (12) | |
| H10A | 0.3531 | 0.4574 | −0.1496 | 0.035* | |
| C11 | 0.4460 (4) | 0.4384 (3) | −0.0714 (2) | 0.0250 (11) | |
| H11A | 0.4706 | 0.4822 | −0.0649 | 0.030* | |
| C12 | 0.4791 (3) | 0.3878 (2) | −0.02999 (19) | 0.0193 (10) | |
| H12A | 0.5252 | 0.3981 | 0.0043 | 0.023* | |
| C13 | 0.5760 (3) | 0.2904 (2) | 0.07033 (18) | 0.0151 (9) | |
| H13A | 0.6342 | 0.3028 | 0.0506 | 0.018* | |
| H13B | 0.5500 | 0.3312 | 0.0865 | 0.018* | |
| C14 | 0.6133 (3) | 0.2414 (2) | 0.12239 (18) | 0.0150 (9) | |
| H14A | 0.6870 | 0.2470 | 0.1343 | 0.018* | |
| H14B | 0.6011 | 0.1953 | 0.1084 | 0.018* | |
| C15 | 0.6075 (3) | 0.3335 (2) | 0.21966 (17) | 0.0136 (9) | |
| C16 | 0.5496 (3) | 0.3908 (2) | 0.22665 (19) | 0.0197 (10) | |
| H16A | 0.4783 | 0.3895 | 0.2156 | 0.024* | |
| C17 | 0.5960 (4) | 0.4502 (2) | 0.2499 (2) | 0.0218 (10) | |
| H17A | 0.5562 | 0.4882 | 0.2543 | 0.026* | |
| C18 | 0.7018 (4) | 0.4523 (2) | 0.2664 (2) | 0.0214 (10) | |
| H18A | 0.7333 | 0.4920 | 0.2818 | 0.026* | |
| C19 | 0.7608 (3) | 0.3960 (2) | 0.26024 (19) | 0.0218 (10) | |
| H19A | 0.8319 | 0.3977 | 0.2718 | 0.026* | |
| C20 | 0.7143 (3) | 0.3364 (2) | 0.23677 (19) | 0.0197 (10) | |
| H20A | 0.7545 | 0.2985 | 0.2325 | 0.024* | |
| C21 | 0.6075 (3) | 0.1921 (2) | 0.24149 (18) | 0.0135 (9) | |
| C22 | 0.5769 (3) | 0.1893 (2) | 0.29748 (19) | 0.0202 (10) | |
| H22A | 0.5294 | 0.2206 | 0.3074 | 0.024* | |
| C23 | 0.6159 (3) | 0.1407 (2) | 0.33913 (19) | 0.0212 (10) | |
| H23A | 0.5939 | 0.1394 | 0.3764 | 0.025* | |
| C24 | 0.6868 (4) | 0.0947 (3) | 0.3253 (2) | 0.0311 (12) | |
| H24A | 0.7121 | 0.0616 | 0.3528 | 0.037* | |
| C25 | 0.7202 (5) | 0.0980 (3) | 0.2704 (2) | 0.0489 (18) | |
| H25A | 0.7694 | 0.0675 | 0.2611 | 0.059* | |
| C26 | 0.6809 (4) | 0.1466 (3) | 0.2288 (2) | 0.0369 (14) | |
| H26A | 0.7043 | 0.1485 | 0.1919 | 0.044* | |
| C27 | −0.0055 (3) | 0.1639 (2) | −0.02139 (18) | 0.0132 (8) | |
| C28 | −0.0395 (3) | 0.0993 (2) | −0.0397 (2) | 0.0177 (9) | |
| H28A | −0.0661 | 0.0709 | −0.0129 | 0.021* | |
| C29 | −0.0341 (3) | 0.0772 (2) | −0.0971 (2) | 0.0188 (9) | |
| H29A | −0.0577 | 0.0343 | −0.1089 | 0.023* | |
| C30 | 0.0063 (3) | 0.1187 (2) | −0.13713 (19) | 0.0157 (9) | |
| C31 | 0.0399 (3) | 0.1832 (2) | −0.12005 (19) | 0.0163 (9) | |
| H31A | 0.0656 | 0.2117 | −0.1471 | 0.020* | |
| C32 | 0.0347 (3) | 0.2047 (2) | −0.06233 (19) | 0.0169 (9) | |
| H32A | 0.0587 | 0.2476 | −0.0506 | 0.020* | |
| C33 | 0.0562 (4) | 0.1309 (3) | −0.2346 (2) | 0.0265 (11) | |
| H33A | 0.0556 | 0.1056 | −0.2709 | 0.040* | |
| H33B | 0.1262 | 0.1408 | −0.2175 | 0.040* | |
| H33C | 0.0190 | 0.1723 | −0.2433 | 0.040* | |
| C34 | −0.0929 (3) | 0.2752 (2) | 0.05044 (18) | 0.0131 (8) | |
| C35 | −0.1244 (3) | 0.3061 (2) | −0.00462 (19) | 0.0174 (9) | |
| H35A | −0.1096 | 0.2856 | −0.0394 | 0.021* | |
| C36 | −0.1773 (3) | 0.3669 (2) | −0.00867 (19) | 0.0185 (10) | |
| H36A | −0.1975 | 0.3870 | −0.0459 | 0.022* | |
| C37 | −0.1999 (3) | 0.3977 (2) | 0.04264 (19) | 0.0168 (9) | |
| C38 | −0.1715 (3) | 0.3668 (2) | 0.09850 (19) | 0.0168 (9) | |
| H38A | −0.1889 | 0.3865 | 0.1330 | 0.020* | |
| C39 | −0.1173 (3) | 0.3066 (2) | 0.10191 (19) | 0.0166 (9) | |
| H39A | −0.0968 | 0.2867 | 0.1391 | 0.020* | |
| C40 | −0.2656 (4) | 0.4963 (2) | −0.0106 (2) | 0.0249 (11) | |
| H40A | −0.2926 | 0.5401 | −0.0033 | 0.037* | |
| H40B | −0.3138 | 0.4728 | −0.0397 | 0.037* | |
| H40C | −0.2012 | 0.5013 | −0.0256 | 0.037* | |
| C41 | −0.0892 (3) | 0.1312 (2) | 0.09426 (18) | 0.0131 (8) | |
| C42 | −0.0492 (3) | 0.0949 (2) | 0.14551 (19) | 0.0177 (9) | |
| H42A | 0.0181 | 0.1031 | 0.1638 | 0.021* | |
| C43 | −0.1069 (3) | 0.0473 (2) | 0.1695 (2) | 0.0184 (9) | |
| H43A | −0.0794 | 0.0245 | 0.2043 | 0.022* | |
| C44 | −0.2068 (3) | 0.0331 (2) | 0.14173 (19) | 0.0162 (9) | |
| C45 | −0.2488 (3) | 0.0692 (2) | 0.09152 (19) | 0.0186 (9) | |
| H45A | −0.3161 | 0.0607 | 0.0734 | 0.022* | |
| C46 | −0.1902 (3) | 0.1182 (2) | 0.06823 (18) | 0.0174 (9) | |
| H46A | −0.2191 | 0.1427 | 0.0347 | 0.021* | |
| C47 | −0.3628 (3) | −0.0276 (3) | 0.1468 (2) | 0.0278 (11) | |
| H47A | −0.3879 | −0.0643 | 0.1683 | 0.042* | |
| H47B | −0.3711 | −0.0384 | 0.1048 | 0.042* | |
| H47C | −0.4012 | 0.0126 | 0.1524 | 0.042* | |
| C48 | 0.4032 (3) | 0.1360 (2) | 0.08991 (19) | 0.0171 (9) | |
| C49 | 0.2750 (3) | 0.1535 (2) | −0.0164 (2) | 0.0191 (10) | |
| C50 | 0.2461 (3) | 0.2880 (2) | 0.01819 (18) | 0.0161 (9) | |
| C51 | 0.3595 (3) | 0.3359 (2) | 0.12580 (19) | 0.0164 (9) | |
| C52 | 0.3433 (3) | 0.2911 (2) | 0.24342 (19) | 0.0154 (9) | |
| C53 | 0.3647 (3) | 0.1630 (2) | 0.20333 (18) | 0.0132 (9) | |
| C54 | 0.1966 (3) | 0.1227 (2) | 0.11232 (19) | 0.0167 (9) | |
| C55 | 0.1310 (3) | 0.2102 (2) | 0.1980 (2) | 0.0189 (9) | |
| C56 | 0.1434 (3) | 0.3135 (2) | 0.11644 (19) | 0.0167 (9) | |
| Cl1 | 0.10327 (11) | 0.02867 (8) | 0.30956 (6) | 0.0430 (4) | |
| Cl2 | 0.00052 (16) | 0.14019 (7) | 0.35662 (7) | 0.0564 (5) | |
| Cl3 | −0.00018 (13) | 0.01080 (9) | 0.41315 (10) | 0.0681 (6) | |
| C57 | 0.0695 (4) | 0.0661 (3) | 0.3742 (2) | 0.0300 (12) | |
| H57A | 0.1334 | 0.0779 | 0.4006 | 0.036* |
| Ru1 | 0.00831 (15) | 0.01602 (18) | 0.01108 (15) | −0.00078 (13) | 0.00201 (12) | −0.00159 (13) |
| Ru2 | 0.00786 (14) | 0.01352 (17) | 0.01036 (15) | −0.00059 (13) | 0.00236 (11) | −0.00060 (13) |
| Ru3 | 0.00776 (15) | 0.01449 (18) | 0.01302 (16) | −0.00043 (13) | 0.00287 (12) | −0.00031 (13) |
| As1 | 0.00888 (19) | 0.0150 (2) | 0.0132 (2) | −0.00037 (16) | 0.00234 (16) | 0.00067 (17) |
| P1 | 0.0102 (5) | 0.0199 (6) | 0.0097 (5) | −0.0008 (4) | 0.0026 (4) | 0.0000 (4) |
| P2 | 0.0093 (5) | 0.0161 (6) | 0.0102 (5) | −0.0001 (4) | 0.0016 (4) | −0.0008 (4) |
| O1 | 0.0218 (17) | 0.0224 (18) | 0.0243 (17) | 0.0062 (14) | 0.0037 (14) | 0.0004 (14) |
| O2 | 0.0264 (19) | 0.039 (2) | 0.037 (2) | 0.0087 (16) | −0.0064 (16) | −0.0211 (18) |
| O3 | 0.0186 (16) | 0.0217 (18) | 0.0212 (16) | 0.0022 (14) | 0.0011 (13) | 0.0018 (14) |
| O4 | 0.0225 (17) | 0.0190 (17) | 0.0229 (17) | −0.0034 (14) | −0.0012 (14) | 0.0037 (14) |
| O5 | 0.0300 (19) | 0.0285 (19) | 0.0201 (17) | 0.0002 (15) | 0.0087 (14) | −0.0084 (15) |
| O6 | 0.0262 (18) | 0.0181 (18) | 0.0207 (16) | −0.0035 (14) | −0.0001 (14) | 0.0019 (14) |
| O7 | 0.0188 (16) | 0.0182 (18) | 0.0310 (18) | −0.0009 (13) | 0.0035 (14) | 0.0014 (14) |
| O8 | 0.034 (2) | 0.035 (2) | 0.0195 (17) | −0.0052 (16) | 0.0118 (15) | −0.0001 (15) |
| O9 | 0.0166 (16) | 0.0200 (19) | 0.042 (2) | 0.0042 (14) | 0.0095 (15) | −0.0027 (16) |
| O10 | 0.0163 (15) | 0.0230 (17) | 0.0185 (15) | −0.0035 (13) | 0.0070 (13) | −0.0067 (13) |
| O11 | 0.0237 (17) | 0.0217 (18) | 0.0208 (16) | 0.0103 (14) | 0.0082 (13) | 0.0040 (14) |
| O12 | 0.0116 (15) | 0.0227 (18) | 0.0271 (17) | −0.0014 (13) | 0.0048 (13) | 0.0060 (14) |
| C1 | 0.011 (2) | 0.026 (3) | 0.0108 (19) | 0.0017 (18) | 0.0022 (16) | −0.0015 (18) |
| C2 | 0.010 (2) | 0.032 (3) | 0.019 (2) | 0.0001 (19) | 0.0027 (17) | −0.008 (2) |
| C3 | 0.020 (2) | 0.033 (3) | 0.026 (3) | 0.003 (2) | −0.001 (2) | −0.012 (2) |
| C4 | 0.016 (2) | 0.047 (3) | 0.018 (2) | 0.008 (2) | 0.0053 (19) | −0.011 (2) |
| C5 | 0.018 (2) | 0.055 (4) | 0.021 (2) | 0.005 (2) | 0.0088 (19) | 0.000 (2) |
| C6 | 0.023 (2) | 0.032 (3) | 0.020 (2) | 0.001 (2) | 0.0025 (19) | 0.000 (2) |
| C7 | 0.012 (2) | 0.027 (3) | 0.0095 (19) | 0.0023 (18) | 0.0073 (16) | 0.0045 (17) |
| C8 | 0.018 (2) | 0.036 (3) | 0.014 (2) | −0.004 (2) | 0.0049 (18) | 0.003 (2) |
| C9 | 0.020 (2) | 0.048 (3) | 0.012 (2) | 0.002 (2) | 0.0048 (18) | 0.007 (2) |
| C10 | 0.027 (3) | 0.040 (3) | 0.023 (2) | 0.017 (2) | 0.011 (2) | 0.013 (2) |
| C11 | 0.032 (3) | 0.023 (3) | 0.023 (2) | 0.006 (2) | 0.014 (2) | 0.005 (2) |
| C12 | 0.019 (2) | 0.025 (3) | 0.015 (2) | 0.0044 (19) | 0.0082 (18) | 0.0017 (19) |
| C13 | 0.0114 (19) | 0.021 (2) | 0.0140 (19) | −0.0030 (17) | 0.0044 (16) | 0.0026 (18) |
| C14 | 0.0113 (19) | 0.021 (2) | 0.0127 (19) | −0.0003 (17) | 0.0009 (16) | −0.0006 (17) |
| C15 | 0.014 (2) | 0.018 (2) | 0.0087 (18) | −0.0061 (17) | 0.0017 (16) | −0.0009 (16) |
| C16 | 0.018 (2) | 0.022 (2) | 0.019 (2) | −0.0064 (19) | 0.0013 (18) | 0.0018 (19) |
| C17 | 0.024 (2) | 0.018 (2) | 0.023 (2) | −0.0043 (19) | 0.0020 (19) | −0.0013 (19) |
| C18 | 0.023 (2) | 0.023 (3) | 0.019 (2) | −0.010 (2) | 0.0051 (19) | −0.0025 (19) |
| C19 | 0.012 (2) | 0.035 (3) | 0.019 (2) | −0.010 (2) | 0.0041 (18) | −0.002 (2) |
| C20 | 0.016 (2) | 0.026 (3) | 0.018 (2) | −0.0036 (19) | 0.0050 (18) | −0.0011 (19) |
| C21 | 0.014 (2) | 0.015 (2) | 0.0119 (19) | −0.0012 (16) | 0.0018 (16) | −0.0004 (16) |
| C22 | 0.015 (2) | 0.029 (3) | 0.018 (2) | 0.0029 (19) | 0.0063 (18) | −0.0003 (19) |
| C23 | 0.017 (2) | 0.036 (3) | 0.012 (2) | −0.001 (2) | 0.0052 (17) | 0.0026 (19) |
| C24 | 0.047 (3) | 0.028 (3) | 0.017 (2) | 0.013 (2) | 0.000 (2) | 0.004 (2) |
| C25 | 0.073 (4) | 0.055 (4) | 0.021 (3) | 0.049 (4) | 0.012 (3) | 0.004 (3) |
| C26 | 0.053 (4) | 0.047 (4) | 0.012 (2) | 0.032 (3) | 0.011 (2) | 0.003 (2) |
| C27 | 0.0091 (19) | 0.017 (2) | 0.0137 (19) | 0.0009 (16) | 0.0021 (15) | −0.0001 (17) |
| C28 | 0.013 (2) | 0.017 (2) | 0.025 (2) | −0.0036 (17) | 0.0081 (18) | 0.0014 (19) |
| C29 | 0.016 (2) | 0.015 (2) | 0.027 (2) | −0.0031 (18) | 0.0082 (18) | −0.0078 (19) |
| C30 | 0.0090 (19) | 0.021 (2) | 0.018 (2) | 0.0044 (17) | 0.0028 (16) | −0.0031 (18) |
| C31 | 0.012 (2) | 0.021 (2) | 0.017 (2) | −0.0001 (17) | 0.0035 (16) | 0.0046 (18) |
| C32 | 0.013 (2) | 0.016 (2) | 0.020 (2) | −0.0030 (17) | −0.0011 (17) | 0.0002 (18) |
| C33 | 0.030 (3) | 0.035 (3) | 0.016 (2) | −0.008 (2) | 0.009 (2) | −0.003 (2) |
| C34 | 0.0088 (19) | 0.015 (2) | 0.016 (2) | −0.0014 (16) | 0.0039 (15) | −0.0017 (17) |
| C35 | 0.016 (2) | 0.023 (2) | 0.014 (2) | 0.0028 (18) | 0.0043 (17) | −0.0040 (18) |
| C36 | 0.021 (2) | 0.020 (2) | 0.013 (2) | 0.0050 (19) | 0.0017 (18) | 0.0024 (18) |
| C37 | 0.014 (2) | 0.014 (2) | 0.022 (2) | 0.0006 (17) | 0.0013 (17) | 0.0020 (18) |
| C38 | 0.015 (2) | 0.021 (2) | 0.016 (2) | 0.0015 (18) | 0.0067 (17) | −0.0018 (18) |
| C39 | 0.011 (2) | 0.025 (2) | 0.014 (2) | −0.0022 (17) | 0.0038 (16) | 0.0034 (18) |
| C40 | 0.032 (3) | 0.024 (3) | 0.021 (2) | 0.010 (2) | 0.012 (2) | 0.007 (2) |
| C41 | 0.0095 (19) | 0.018 (2) | 0.014 (2) | −0.0001 (16) | 0.0084 (16) | −0.0024 (17) |
| C42 | 0.014 (2) | 0.020 (2) | 0.018 (2) | 0.0023 (18) | −0.0010 (17) | 0.0021 (18) |
| C43 | 0.017 (2) | 0.019 (2) | 0.019 (2) | 0.0028 (18) | 0.0026 (18) | 0.0022 (19) |
| C44 | 0.016 (2) | 0.014 (2) | 0.021 (2) | 0.0002 (17) | 0.0088 (17) | −0.0032 (18) |
| C45 | 0.012 (2) | 0.023 (2) | 0.021 (2) | −0.0016 (18) | 0.0022 (17) | 0.0000 (19) |
| C46 | 0.017 (2) | 0.023 (2) | 0.011 (2) | 0.0025 (18) | 0.0010 (17) | 0.0016 (18) |
| C47 | 0.014 (2) | 0.027 (3) | 0.042 (3) | −0.002 (2) | 0.006 (2) | 0.009 (2) |
| C48 | 0.013 (2) | 0.025 (3) | 0.013 (2) | −0.0073 (18) | 0.0011 (17) | −0.0018 (18) |
| C49 | 0.014 (2) | 0.022 (2) | 0.020 (2) | 0.0030 (18) | −0.0014 (18) | −0.0025 (19) |
| C50 | 0.0107 (19) | 0.024 (2) | 0.014 (2) | −0.0072 (18) | 0.0034 (16) | −0.0024 (19) |
| C51 | 0.0063 (19) | 0.025 (3) | 0.017 (2) | −0.0029 (17) | 0.0010 (16) | −0.0033 (19) |
| C52 | 0.011 (2) | 0.018 (2) | 0.018 (2) | 0.0008 (17) | 0.0053 (16) | 0.0014 (18) |
| C53 | 0.0087 (19) | 0.017 (2) | 0.014 (2) | 0.0003 (16) | 0.0028 (16) | −0.0058 (18) |
| C54 | 0.009 (2) | 0.023 (3) | 0.017 (2) | −0.0014 (17) | −0.0006 (16) | 0.0041 (18) |
| C55 | 0.014 (2) | 0.017 (2) | 0.027 (2) | 0.0002 (18) | 0.0047 (18) | −0.003 (2) |
| C56 | 0.0084 (19) | 0.024 (3) | 0.019 (2) | −0.0026 (17) | 0.0041 (16) | −0.0015 (19) |
| Cl1 | 0.0401 (8) | 0.0504 (9) | 0.0371 (7) | 0.0130 (7) | 0.0012 (6) | −0.0164 (7) |
| Cl2 | 0.1012 (14) | 0.0258 (8) | 0.0519 (9) | 0.0151 (8) | 0.0433 (10) | 0.0064 (7) |
| Cl3 | 0.0499 (10) | 0.0429 (10) | 0.1242 (17) | 0.0157 (8) | 0.0542 (11) | 0.0373 (10) |
| C57 | 0.027 (3) | 0.035 (3) | 0.030 (3) | −0.009 (2) | 0.012 (2) | −0.005 (2) |
| Ru1—C49 | 1.899 (4) | C15—C16 | 1.387 (6) |
| Ru1—C48 | 1.926 (5) | C15—C20 | 1.396 (6) |
| Ru1—C50 | 1.945 (5) | C16—C17 | 1.390 (6) |
| Ru1—P1 | 2.3291 (11) | C16—H16A | 0.9300 |
| Ru1—Ru2 | 2.8439 (4) | C17—C18 | 1.381 (6) |
| Ru1—Ru3 | 2.8694 (5) | C17—H17A | 0.9300 |
| Ru2—C52 | 1.886 (4) | C18—C19 | 1.376 (7) |
| Ru2—C51 | 1.922 (5) | C18—H18A | 0.9300 |
| Ru2—C53 | 1.932 (4) | C19—C20 | 1.396 (6) |
| Ru2—P2 | 2.3225 (11) | C19—H19A | 0.9300 |
| Ru2—Ru3 | 2.8221 (4) | C20—H20A | 0.9300 |
| Ru3—C55 | 1.875 (5) | C21—C26 | 1.380 (6) |
| Ru3—C54 | 1.924 (5) | C21—C22 | 1.383 (6) |
| Ru3—C56 | 1.935 (5) | C22—C23 | 1.387 (6) |
| Ru3—As1 | 2.4558 (5) | C22—H22A | 0.9300 |
| As1—C41 | 1.942 (4) | C23—C24 | 1.371 (7) |
| As1—C27 | 1.944 (4) | C23—H23A | 0.9300 |
| As1—C34 | 1.946 (4) | C24—C25 | 1.377 (7) |
| P1—C7 | 1.827 (4) | C24—H24A | 0.9300 |
| P1—C1 | 1.836 (5) | C25—C26 | 1.387 (7) |
| P1—C13 | 1.845 (4) | C25—H25A | 0.9300 |
| P2—C21 | 1.828 (4) | C26—H26A | 0.9300 |
| P2—C14 | 1.837 (4) | C27—C32 | 1.390 (6) |
| P2—C15 | 1.837 (4) | C27—C28 | 1.397 (6) |
| O1—C48 | 1.146 (5) | C28—C29 | 1.378 (6) |
| O2—C49 | 1.141 (5) | C28—H28A | 0.9300 |
| O3—C50 | 1.144 (5) | C29—C30 | 1.384 (6) |
| O4—C51 | 1.157 (5) | C29—H29A | 0.9300 |
| O5—C52 | 1.149 (5) | C30—C31 | 1.388 (6) |
| O6—C53 | 1.148 (5) | C31—C32 | 1.381 (6) |
| O7—C54 | 1.152 (5) | C31—H31A | 0.9300 |
| O8—C55 | 1.155 (5) | C32—H32A | 0.9300 |
| O9—C56 | 1.147 (5) | C33—H33A | 0.9600 |
| O10—C30 | 1.373 (5) | C33—H33B | 0.9600 |
| O10—C33 | 1.419 (5) | C33—H33C | 0.9600 |
| O11—C37 | 1.372 (5) | C34—C35 | 1.391 (6) |
| O11—C40 | 1.432 (5) | C34—C39 | 1.397 (6) |
| O12—C44 | 1.367 (5) | C35—C36 | 1.386 (6) |
| O12—C47 | 1.430 (5) | C35—H35A | 0.9300 |
| C1—C2 | 1.382 (6) | C36—C37 | 1.380 (6) |
| C1—C6 | 1.415 (6) | C36—H36A | 0.9300 |
| C2—C3 | 1.393 (6) | C37—C38 | 1.400 (6) |
| C2—H2A | 0.9300 | C38—C39 | 1.384 (6) |
| C3—C4 | 1.373 (7) | C38—H38A | 0.9300 |
| C3—H3A | 0.9300 | C39—H39A | 0.9300 |
| C4—C5 | 1.375 (8) | C40—H40A | 0.9600 |
| C4—H4A | 0.9300 | C40—H40B | 0.9600 |
| C5—C6 | 1.386 (7) | C40—H40C | 0.9600 |
| C5—H5A | 0.9300 | C41—C46 | 1.389 (6) |
| C6—H6A | 0.9300 | C41—C42 | 1.395 (6) |
| C7—C12 | 1.389 (6) | C42—C43 | 1.370 (6) |
| C7—C8 | 1.405 (6) | C42—H42A | 0.9300 |
| C8—C9 | 1.378 (7) | C43—C44 | 1.393 (6) |
| C8—H8A | 0.9300 | C43—H43A | 0.9300 |
| C9—C10 | 1.382 (7) | C44—C45 | 1.381 (6) |
| C9—H9A | 0.9300 | C45—C46 | 1.389 (6) |
| C10—C11 | 1.387 (7) | C45—H45A | 0.9300 |
| C10—H10A | 0.9300 | C46—H46A | 0.9300 |
| C11—C12 | 1.394 (6) | C47—H47A | 0.9600 |
| C11—H11A | 0.9300 | C47—H47B | 0.9600 |
| C12—H12A | 0.9300 | C47—H47C | 0.9600 |
| C13—C14 | 1.545 (6) | Cl1—C57 | 1.751 (5) |
| C13—H13A | 0.9700 | Cl2—C57 | 1.737 (6) |
| C13—H13B | 0.9700 | Cl3—C57 | 1.746 (5) |
| C14—H14A | 0.9700 | C57—H57A | 0.9800 |
| C14—H14B | 0.9700 | ||
| C49—Ru1—C48 | 91.33 (18) | C17—C16—H16A | 119.4 |
| C49—Ru1—C50 | 94.22 (18) | C18—C17—C16 | 119.5 (5) |
| C48—Ru1—C50 | 171.82 (18) | C18—C17—H17A | 120.2 |
| C49—Ru1—P1 | 100.57 (14) | C16—C17—H17A | 120.2 |
| C48—Ru1—P1 | 93.20 (13) | C19—C18—C17 | 120.3 (4) |
| C50—Ru1—P1 | 91.67 (13) | C19—C18—H18A | 119.9 |
| C49—Ru1—Ru2 | 156.51 (14) | C17—C18—H18A | 119.9 |
| C48—Ru1—Ru2 | 75.81 (13) | C18—C19—C20 | 120.2 (4) |
| C50—Ru1—Ru2 | 96.90 (12) | C18—C19—H19A | 119.9 |
| P1—Ru1—Ru2 | 99.71 (3) | C20—C19—H19A | 119.9 |
| C49—Ru1—Ru3 | 104.31 (14) | C19—C20—C15 | 120.1 (4) |
| C48—Ru1—Ru3 | 97.61 (13) | C19—C20—H20A | 119.9 |
| C50—Ru1—Ru3 | 75.21 (12) | C15—C20—H20A | 119.9 |
| P1—Ru1—Ru3 | 152.54 (3) | C26—C21—C22 | 118.1 (4) |
| Ru2—Ru1—Ru3 | 59.199 (11) | C26—C21—P2 | 123.4 (3) |
| C52—Ru2—C51 | 96.26 (18) | C22—C21—P2 | 118.5 (3) |
| C52—Ru2—C53 | 90.92 (18) | C21—C22—C23 | 121.2 (4) |
| C51—Ru2—C53 | 170.33 (17) | C21—C22—H22A | 119.4 |
| C52—Ru2—P2 | 98.79 (13) | C23—C22—H22A | 119.4 |
| C51—Ru2—P2 | 93.15 (12) | C24—C23—C22 | 120.0 (4) |
| C53—Ru2—P2 | 92.13 (12) | C24—C23—H23A | 120.0 |
| C52—Ru2—Ru3 | 99.71 (12) | C22—C23—H23A | 120.0 |
| C51—Ru2—Ru3 | 91.50 (12) | C23—C24—C25 | 119.5 (5) |
| C53—Ru2—Ru3 | 80.89 (11) | C23—C24—H24A | 120.3 |
| P2—Ru2—Ru3 | 160.31 (3) | C25—C24—H24A | 120.3 |
| C52—Ru2—Ru1 | 158.34 (12) | C24—C25—C26 | 120.4 (5) |
| C51—Ru2—Ru1 | 76.13 (13) | C24—C25—H25A | 119.8 |
| C53—Ru2—Ru1 | 94.86 (12) | C26—C25—H25A | 119.8 |
| P2—Ru2—Ru1 | 101.83 (3) | C21—C26—C25 | 120.8 (5) |
| Ru3—Ru2—Ru1 | 60.850 (11) | C21—C26—H26A | 119.6 |
| C55—Ru3—C54 | 96.09 (19) | C25—C26—H26A | 119.6 |
| C55—Ru3—C56 | 93.41 (19) | C32—C27—C28 | 118.2 (4) |
| C54—Ru3—C56 | 170.41 (19) | C32—C27—As1 | 119.1 (3) |
| C55—Ru3—As1 | 100.39 (13) | C28—C27—As1 | 122.6 (3) |
| C54—Ru3—As1 | 88.34 (12) | C29—C28—C27 | 120.5 (4) |
| C56—Ru3—As1 | 91.27 (12) | C29—C28—H28A | 119.7 |
| C55—Ru3—Ru2 | 89.58 (13) | C27—C28—H28A | 119.7 |
| C54—Ru3—Ru2 | 94.72 (12) | C28—C29—C30 | 120.3 (4) |
| C56—Ru3—Ru2 | 83.98 (12) | C28—C29—H29A | 119.9 |
| As1—Ru3—Ru2 | 169.216 (19) | C30—C29—H29A | 119.9 |
| C55—Ru3—Ru1 | 145.84 (13) | O10—C30—C29 | 116.2 (4) |
| C54—Ru3—Ru1 | 73.39 (13) | O10—C30—C31 | 123.6 (4) |
| C56—Ru3—Ru1 | 97.89 (13) | C29—C30—C31 | 120.1 (4) |
| As1—Ru3—Ru1 | 111.410 (17) | C32—C31—C30 | 119.1 (4) |
| Ru2—Ru3—Ru1 | 59.951 (11) | C32—C31—H31A | 120.4 |
| C41—As1—C27 | 103.39 (17) | C30—C31—H31A | 120.4 |
| C41—As1—C34 | 101.75 (17) | C31—C32—C27 | 121.7 (4) |
| C27—As1—C34 | 103.68 (17) | C31—C32—H32A | 119.2 |
| C41—As1—Ru3 | 114.73 (12) | C27—C32—H32A | 119.2 |
| C27—As1—Ru3 | 117.48 (12) | O10—C33—H33A | 109.5 |
| C34—As1—Ru3 | 113.92 (12) | O10—C33—H33B | 109.5 |
| C7—P1—C1 | 102.4 (2) | H33A—C33—H33B | 109.5 |
| C7—P1—C13 | 102.9 (2) | O10—C33—H33C | 109.5 |
| C1—P1—C13 | 101.18 (19) | H33A—C33—H33C | 109.5 |
| C7—P1—Ru1 | 112.81 (14) | H33B—C33—H33C | 109.5 |
| C1—P1—Ru1 | 117.63 (15) | C35—C34—C39 | 118.2 (4) |
| C13—P1—Ru1 | 117.75 (14) | C35—C34—As1 | 123.1 (3) |
| C21—P2—C14 | 103.13 (19) | C39—C34—As1 | 118.3 (3) |
| C21—P2—C15 | 101.82 (18) | C36—C35—C34 | 121.3 (4) |
| C14—P2—C15 | 102.47 (19) | C36—C35—H35A | 119.3 |
| C21—P2—Ru2 | 114.83 (14) | C34—C35—H35A | 119.3 |
| C14—P2—Ru2 | 116.38 (13) | C37—C36—C35 | 119.8 (4) |
| C15—P2—Ru2 | 116.16 (14) | C37—C36—H36A | 120.1 |
| C30—O10—C33 | 118.5 (3) | C35—C36—H36A | 120.1 |
| C37—O11—C40 | 116.4 (3) | O11—C37—C36 | 124.9 (4) |
| C44—O12—C47 | 117.4 (3) | O11—C37—C38 | 115.1 (4) |
| C2—C1—C6 | 117.8 (4) | C36—C37—C38 | 120.0 (4) |
| C2—C1—P1 | 122.7 (3) | C39—C38—C37 | 119.4 (4) |
| C6—C1—P1 | 119.5 (4) | C39—C38—H38A | 120.3 |
| C1—C2—C3 | 121.2 (4) | C37—C38—H38A | 120.3 |
| C1—C2—H2A | 119.4 | C38—C39—C34 | 121.2 (4) |
| C3—C2—H2A | 119.4 | C38—C39—H39A | 119.4 |
| C4—C3—C2 | 120.2 (5) | C34—C39—H39A | 119.4 |
| C4—C3—H3A | 119.9 | O11—C40—H40A | 109.5 |
| C2—C3—H3A | 119.9 | O11—C40—H40B | 109.5 |
| C3—C4—C5 | 119.9 (5) | H40A—C40—H40B | 109.5 |
| C3—C4—H4A | 120.1 | O11—C40—H40C | 109.5 |
| C5—C4—H4A | 120.1 | H40A—C40—H40C | 109.5 |
| C4—C5—C6 | 120.7 (5) | H40B—C40—H40C | 109.5 |
| C4—C5—H5A | 119.7 | C46—C41—C42 | 118.0 (4) |
| C6—C5—H5A | 119.7 | C46—C41—As1 | 121.8 (3) |
| C5—C6—C1 | 120.2 (5) | C42—C41—As1 | 120.2 (3) |
| C5—C6—H6A | 119.9 | C43—C42—C41 | 121.4 (4) |
| C1—C6—H6A | 119.9 | C43—C42—H42A | 119.3 |
| C12—C7—C8 | 118.6 (4) | C41—C42—H42A | 119.3 |
| C12—C7—P1 | 124.0 (3) | C42—C43—C44 | 119.9 (4) |
| C8—C7—P1 | 117.3 (4) | C42—C43—H43A | 120.0 |
| C9—C8—C7 | 120.6 (5) | C44—C43—H43A | 120.0 |
| C9—C8—H8A | 119.7 | O12—C44—C45 | 125.5 (4) |
| C7—C8—H8A | 119.7 | O12—C44—C43 | 114.8 (4) |
| C8—C9—C10 | 120.5 (4) | C45—C44—C43 | 119.7 (4) |
| C8—C9—H9A | 119.8 | C44—C45—C46 | 119.8 (4) |
| C10—C9—H9A | 119.8 | C44—C45—H45A | 120.1 |
| C9—C10—C11 | 119.7 (4) | C46—C45—H45A | 120.1 |
| C9—C10—H10A | 120.2 | C45—C46—C41 | 121.0 (4) |
| C11—C10—H10A | 120.2 | C45—C46—H46A | 119.5 |
| C10—C11—C12 | 120.1 (5) | C41—C46—H46A | 119.5 |
| C10—C11—H11A | 119.9 | O12—C47—H47A | 109.5 |
| C12—C11—H11A | 119.9 | O12—C47—H47B | 109.5 |
| C7—C12—C11 | 120.5 (4) | H47A—C47—H47B | 109.5 |
| C7—C12—H12A | 119.8 | O12—C47—H47C | 109.5 |
| C11—C12—H12A | 119.8 | H47A—C47—H47C | 109.5 |
| C14—C13—P1 | 112.5 (3) | H47B—C47—H47C | 109.5 |
| C14—C13—H13A | 109.1 | O1—C48—Ru1 | 172.1 (4) |
| P1—C13—H13A | 109.1 | O2—C49—Ru1 | 174.1 (4) |
| C14—C13—H13B | 109.1 | O3—C50—Ru1 | 172.3 (4) |
| P1—C13—H13B | 109.1 | O4—C51—Ru2 | 173.3 (4) |
| H13A—C13—H13B | 107.8 | O5—C52—Ru2 | 179.4 (4) |
| C13—C14—P2 | 112.8 (3) | O6—C53—Ru2 | 175.5 (4) |
| C13—C14—H14A | 109.0 | O7—C54—Ru3 | 172.7 (4) |
| P2—C14—H14A | 109.0 | O8—C55—Ru3 | 175.9 (4) |
| C13—C14—H14B | 109.0 | O9—C56—Ru3 | 175.4 (4) |
| P2—C14—H14B | 109.0 | Cl2—C57—Cl3 | 110.5 (3) |
| H14A—C14—H14B | 107.8 | Cl2—C57—Cl1 | 110.9 (3) |
| C16—C15—C20 | 118.6 (4) | Cl3—C57—Cl1 | 111.8 (3) |
| C16—C15—P2 | 121.9 (3) | Cl2—C57—H57A | 107.8 |
| C20—C15—P2 | 119.5 (3) | Cl3—C57—H57A | 107.8 |
| C15—C16—C17 | 121.2 (4) | Cl1—C57—H57A | 107.8 |
| C15—C16—H16A | 119.4 | ||
| C49—Ru1—Ru2—C52 | −77.7 (5) | C7—P1—C1—C2 | −133.3 (4) |
| C48—Ru1—Ru2—C52 | −136.2 (4) | C13—P1—C1—C2 | 120.7 (4) |
| C50—Ru1—Ru2—C52 | 40.0 (4) | Ru1—P1—C1—C2 | −9.1 (4) |
| P1—Ru1—Ru2—C52 | 132.9 (4) | C7—P1—C1—C6 | 46.2 (4) |
| Ru3—Ru1—Ru2—C52 | −28.2 (4) | C13—P1—C1—C6 | −59.8 (4) |
| C49—Ru1—Ru2—C51 | −149.2 (4) | Ru1—P1—C1—C6 | 170.4 (3) |
| C48—Ru1—Ru2—C51 | 152.25 (18) | C6—C1—C2—C3 | 1.0 (6) |
| C50—Ru1—Ru2—C51 | −31.51 (17) | P1—C1—C2—C3 | −179.5 (3) |
| P1—Ru1—Ru2—C51 | 61.39 (13) | C1—C2—C3—C4 | −1.1 (7) |
| Ru3—Ru1—Ru2—C51 | −99.70 (12) | C2—C3—C4—C5 | 0.4 (7) |
| C49—Ru1—Ru2—C53 | 27.2 (3) | C3—C4—C5—C6 | 0.4 (7) |
| C48—Ru1—Ru2—C53 | −31.31 (18) | C4—C5—C6—C1 | −0.4 (7) |
| C50—Ru1—Ru2—C53 | 144.93 (17) | C2—C1—C6—C5 | −0.2 (6) |
| P1—Ru1—Ru2—C53 | −122.17 (12) | P1—C1—C6—C5 | −179.8 (3) |
| Ru3—Ru1—Ru2—C53 | 76.74 (12) | C1—P1—C7—C12 | −115.5 (4) |
| C49—Ru1—Ru2—P2 | 120.5 (3) | C13—P1—C7—C12 | −10.8 (4) |
| C48—Ru1—Ru2—P2 | 61.90 (13) | Ru1—P1—C7—C12 | 117.1 (4) |
| C50—Ru1—Ru2—P2 | −121.86 (12) | C1—P1—C7—C8 | 69.0 (4) |
| P1—Ru1—Ru2—P2 | −28.97 (4) | C13—P1—C7—C8 | 173.7 (3) |
| Ru3—Ru1—Ru2—P2 | 169.94 (3) | Ru1—P1—C7—C8 | −58.3 (4) |
| C49—Ru1—Ru2—Ru3 | −49.5 (3) | C12—C7—C8—C9 | −0.4 (7) |
| C48—Ru1—Ru2—Ru3 | −108.05 (13) | P1—C7—C8—C9 | 175.3 (4) |
| C50—Ru1—Ru2—Ru3 | 68.19 (12) | C7—C8—C9—C10 | −0.5 (7) |
| P1—Ru1—Ru2—Ru3 | 161.09 (3) | C8—C9—C10—C11 | 1.5 (7) |
| C52—Ru2—Ru3—C55 | −26.39 (19) | C9—C10—C11—C12 | −1.5 (7) |
| C51—Ru2—Ru3—C55 | −123.00 (19) | C8—C7—C12—C11 | 0.4 (6) |
| C53—Ru2—Ru3—C55 | 62.98 (18) | P1—C7—C12—C11 | −175.0 (3) |
| P2—Ru2—Ru3—C55 | 133.32 (16) | C10—C11—C12—C7 | 0.6 (7) |
| Ru1—Ru2—Ru3—C55 | 163.80 (14) | C7—P1—C13—C14 | 178.7 (3) |
| C52—Ru2—Ru3—C54 | −122.47 (19) | C1—P1—C13—C14 | −75.7 (3) |
| C51—Ru2—Ru3—C54 | 140.92 (19) | Ru1—P1—C13—C14 | 54.0 (3) |
| C53—Ru2—Ru3—C54 | −33.09 (18) | P1—C13—C14—P2 | −95.4 (3) |
| P2—Ru2—Ru3—C54 | 37.25 (16) | C21—P2—C14—C13 | −179.3 (3) |
| Ru1—Ru2—Ru3—C54 | 67.73 (13) | C15—P2—C14—C13 | −73.8 (3) |
| C52—Ru2—Ru3—C56 | 67.08 (18) | Ru2—P2—C14—C13 | 54.1 (3) |
| C51—Ru2—Ru3—C56 | −29.53 (18) | C21—P2—C15—C16 | −132.4 (4) |
| C53—Ru2—Ru3—C56 | 156.45 (18) | C14—P2—C15—C16 | 121.1 (4) |
| P2—Ru2—Ru3—C56 | −133.21 (16) | Ru2—P2—C15—C16 | −6.9 (4) |
| Ru1—Ru2—Ru3—C56 | −102.73 (13) | C21—P2—C15—C20 | 48.3 (4) |
| C52—Ru2—Ru3—As1 | 131.37 (17) | C14—P2—C15—C20 | −58.2 (4) |
| C51—Ru2—Ru3—As1 | 34.76 (17) | Ru2—P2—C15—C20 | 173.8 (3) |
| C53—Ru2—Ru3—As1 | −139.26 (16) | C20—C15—C16—C17 | 0.3 (6) |
| P2—Ru2—Ru3—As1 | −68.92 (15) | P2—C15—C16—C17 | −179.0 (3) |
| Ru1—Ru2—Ru3—As1 | −38.44 (10) | C15—C16—C17—C18 | 0.0 (7) |
| C52—Ru2—Ru3—Ru1 | 169.81 (13) | C16—C17—C18—C19 | −0.4 (7) |
| C51—Ru2—Ru3—Ru1 | 73.20 (13) | C17—C18—C19—C20 | 0.6 (7) |
| C53—Ru2—Ru3—Ru1 | −100.82 (12) | C18—C19—C20—C15 | −0.3 (7) |
| P2—Ru2—Ru3—Ru1 | −30.47 (9) | C16—C15—C20—C19 | −0.1 (6) |
| C49—Ru1—Ru3—C55 | 132.0 (3) | P2—C15—C20—C19 | 179.1 (3) |
| C48—Ru1—Ru3—C55 | 38.6 (3) | C14—P2—C21—C26 | −2.0 (5) |
| C50—Ru1—Ru3—C55 | −137.4 (3) | C15—P2—C21—C26 | −108.0 (4) |
| P1—Ru1—Ru3—C55 | −73.6 (3) | Ru2—P2—C21—C26 | 125.6 (4) |
| Ru2—Ru1—Ru3—C55 | −29.8 (2) | C14—P2—C21—C22 | 178.7 (3) |
| C49—Ru1—Ru3—C54 | 56.01 (18) | C15—P2—C21—C22 | 72.7 (4) |
| C48—Ru1—Ru3—C54 | −37.34 (17) | Ru2—P2—C21—C22 | −53.7 (4) |
| C50—Ru1—Ru3—C54 | 146.65 (17) | C26—C21—C22—C23 | −2.3 (7) |
| P1—Ru1—Ru3—C54 | −149.61 (14) | P2—C21—C22—C23 | 177.1 (3) |
| Ru2—Ru1—Ru3—C54 | −105.77 (12) | C21—C22—C23—C24 | 0.6 (7) |
| C49—Ru1—Ru3—C56 | −119.90 (18) | C22—C23—C24—C25 | 1.2 (8) |
| C48—Ru1—Ru3—C56 | 146.75 (17) | C23—C24—C25—C26 | −1.4 (10) |
| C50—Ru1—Ru3—C56 | −29.26 (17) | C22—C21—C26—C25 | 2.1 (8) |
| P1—Ru1—Ru3—C56 | 34.48 (14) | P2—C21—C26—C25 | −177.2 (5) |
| Ru2—Ru1—Ru3—C56 | 78.32 (12) | C24—C25—C26—C21 | −0.4 (10) |
| C49—Ru1—Ru3—As1 | −25.40 (14) | C41—As1—C27—C32 | 169.6 (3) |
| C48—Ru1—Ru3—As1 | −118.75 (12) | C34—As1—C27—C32 | 63.8 (3) |
| C50—Ru1—Ru3—As1 | 65.24 (12) | Ru3—As1—C27—C32 | −62.9 (3) |
| P1—Ru1—Ru3—As1 | 128.98 (6) | C41—As1—C27—C28 | −14.7 (4) |
| Ru2—Ru1—Ru3—As1 | 172.82 (2) | C34—As1—C27—C28 | −120.5 (3) |
| C49—Ru1—Ru3—Ru2 | 161.77 (14) | Ru3—As1—C27—C28 | 112.8 (3) |
| C48—Ru1—Ru3—Ru2 | 68.43 (12) | C32—C27—C28—C29 | −0.7 (6) |
| C50—Ru1—Ru3—Ru2 | −107.58 (12) | As1—C27—C28—C29 | −176.4 (3) |
| P1—Ru1—Ru3—Ru2 | −43.85 (6) | C27—C28—C29—C30 | 0.7 (6) |
| C55—Ru3—As1—C41 | −35.50 (19) | C33—O10—C30—C29 | −175.5 (4) |
| C54—Ru3—As1—C41 | 60.39 (19) | C33—O10—C30—C31 | 5.6 (6) |
| C56—Ru3—As1—C41 | −129.19 (19) | C28—C29—C30—O10 | 179.9 (4) |
| Ru2—Ru3—As1—C41 | 167.14 (16) | C28—C29—C30—C31 | −1.2 (6) |
| Ru1—Ru3—As1—C41 | 131.82 (13) | O10—C30—C31—C32 | −179.6 (4) |
| C55—Ru3—As1—C27 | −157.3 (2) | C29—C30—C31—C32 | 1.5 (6) |
| C54—Ru3—As1—C27 | −61.41 (19) | C30—C31—C32—C27 | −1.5 (6) |
| C56—Ru3—As1—C27 | 109.00 (19) | C28—C27—C32—C31 | 1.0 (6) |
| Ru2—Ru3—As1—C27 | 45.33 (18) | As1—C27—C32—C31 | 176.9 (3) |
| Ru1—Ru3—As1—C27 | 10.02 (14) | C41—As1—C34—C35 | −121.1 (4) |
| C55—Ru3—As1—C34 | 81.22 (19) | C27—As1—C34—C35 | −14.0 (4) |
| C54—Ru3—As1—C34 | 177.11 (19) | Ru3—As1—C34—C35 | 114.8 (3) |
| C56—Ru3—As1—C34 | −12.48 (19) | C41—As1—C34—C39 | 66.1 (3) |
| Ru2—Ru3—As1—C34 | −76.15 (17) | C27—As1—C34—C39 | 173.2 (3) |
| Ru1—Ru3—As1—C34 | −111.46 (14) | Ru3—As1—C34—C39 | −58.0 (3) |
| C49—Ru1—P1—C7 | 79.4 (2) | C39—C34—C35—C36 | 0.9 (6) |
| C48—Ru1—P1—C7 | 171.4 (2) | As1—C34—C35—C36 | −171.9 (3) |
| C50—Ru1—P1—C7 | −15.2 (2) | C34—C35—C36—C37 | −0.2 (7) |
| Ru2—Ru1—P1—C7 | −112.51 (16) | C40—O11—C37—C36 | −8.9 (6) |
| Ru3—Ru1—P1—C7 | −75.37 (17) | C40—O11—C37—C38 | 170.9 (4) |
| C49—Ru1—P1—C1 | −39.4 (2) | C35—C36—C37—O11 | 178.3 (4) |
| C48—Ru1—P1—C1 | 52.53 (19) | C35—C36—C37—C38 | −1.5 (7) |
| C50—Ru1—P1—C1 | −134.04 (19) | O11—C37—C38—C39 | −177.3 (4) |
| Ru2—Ru1—P1—C1 | 128.67 (15) | C36—C37—C38—C39 | 2.4 (6) |
| Ru3—Ru1—P1—C1 | 165.80 (14) | C37—C38—C39—C34 | −1.8 (6) |
| C49—Ru1—P1—C13 | −160.9 (2) | C35—C34—C39—C38 | 0.1 (6) |
| C48—Ru1—P1—C13 | −69.0 (2) | As1—C34—C39—C38 | 173.3 (3) |
| C50—Ru1—P1—C13 | 104.4 (2) | C27—As1—C41—C46 | −56.4 (4) |
| Ru2—Ru1—P1—C13 | 7.16 (17) | C34—As1—C41—C46 | 50.9 (4) |
| Ru3—Ru1—P1—C13 | 44.29 (19) | Ru3—As1—C41—C46 | 174.4 (3) |
| C52—Ru2—P2—C21 | 73.6 (2) | C27—As1—C41—C42 | 122.2 (4) |
| C51—Ru2—P2—C21 | 170.4 (2) | C34—As1—C41—C42 | −130.5 (3) |
| C53—Ru2—P2—C21 | −17.69 (19) | Ru3—As1—C41—C42 | −7.0 (4) |
| Ru3—Ru2—P2—C21 | −86.20 (18) | C46—C41—C42—C43 | 0.5 (7) |
| Ru1—Ru2—P2—C21 | −113.11 (15) | As1—C41—C42—C43 | −178.1 (3) |
| C52—Ru2—P2—C14 | −165.8 (2) | C41—C42—C43—C44 | 1.7 (7) |
| C51—Ru2—P2—C14 | −69.0 (2) | C47—O12—C44—C45 | −6.5 (6) |
| C53—Ru2—P2—C14 | 102.9 (2) | C47—O12—C44—C43 | 172.5 (4) |
| Ru3—Ru2—P2—C14 | 34.4 (2) | C42—C43—C44—O12 | 178.2 (4) |
| Ru1—Ru2—P2—C14 | 7.48 (16) | C42—C43—C44—C45 | −2.7 (7) |
| C52—Ru2—P2—C15 | −45.0 (2) | O12—C44—C45—C46 | −179.5 (4) |
| C51—Ru2—P2—C15 | 51.8 (2) | C43—C44—C45—C46 | 1.5 (7) |
| C53—Ru2—P2—C15 | −136.30 (19) | C44—C45—C46—C41 | 0.7 (7) |
| Ru3—Ru2—P2—C15 | 155.19 (15) | C42—C41—C46—C45 | −1.7 (6) |
| Ru1—Ru2—P2—C15 | 128.28 (15) | As1—C41—C46—C45 | 176.8 (3) |
| Cg1, Cg2 and Cg3 are the centroids of the C34–C39, C7–C12 and C1–C6 benzene rings, respectively. |
| H··· | ||||
| C19—H19A···O10i | 0.93 | 2.34 | 3.269 (5) | 176 |
| C43—H43A···O10ii | 0.93 | 2.52 | 3.065 (5) | 118 |
| C47—H47C···O1iii | 0.96 | 2.56 | 3.400 (6) | 146 |
| C13—H13A···Cg1iv | 0.97 | 2.96 | 3.856 (4) | 155 |
| C23—H23A···Cg2v | 0.93 | 2.73 | 3.467 (4) | 137 |
| C46—H46A···Cg3iii | 0.93 | 2.83 | 3.623 (4) | 145 |
Hydrogen-bond geometry (Å, °)
Cg1, Cg2 and Cg3 are the centroids of the C34–C39, C7–C12 and C1–C6 benzene rings, respectively.
| H⋯ | ||||
|---|---|---|---|---|
| C19—H19 | 0.93 | 2.34 | 3.269 (5) | 176 |
| C43—H43 | 0.93 | 2.52 | 3.065 (5) | 118 |
| C47—H47 | 0.96 | 2.56 | 3.400 (6) | 146 |
| C13—H13 | 0.97 | 2.96 | 3.856 (4) | 155 |
| C23—H23 | 0.93 | 2.73 | 3.467 (4) | 137 |
| C46—H46 | 0.93 | 2.83 | 3.623 (4) | 145 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) ; (v) .