| Literature DB >> 21201586 |
Xin-Sheng Li1, Juan Mo, Su-Mei Zhang, Li Yuan, Jian-Hua Liu.
Abstract
The title complex, [Au(2)(C(17)H(11)N)(2)(C(12)H(10)P)]ClO(4)·C(2)H(3)N, contains two Au(III) atoms bridged by a diphenyl-phosphanide ligand. Each Au atom is in a square-planar environment coordinated by diphenyl-phosphanide and 2,6-diphenyl-pyridine ligands. There are weak π-π stacking inter-actions between neighbouring mol-ecules (the inter-planar separations between two neighbouring dpp units are 3.40 and 3.57 Å). The intra-molecular Au⋯Au separation is 3.788 (5) Å. The crystal structure shows weak inter-molecular C-H⋯O and C-H⋯N hydrogen bonds involving an O atom of the perchlorate counter-ion and the N atom of the acetonitrile solvent mol-ecule, respectively.Entities:
Year: 2008 PMID: 21201586 PMCID: PMC2960555 DOI: 10.1107/S1600536808024537
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Au2(C17H11N)2(C12H10P)]ClO4·C2H3N | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 13552 reflections |
| θ = 1.4–28.7º | |
| µ = 7.51 mm−1 | |
| β = 98.828 (4)º | Block, yellow |
| 0.32 × 0.22 × 0.20 mm | |
| Bruker SMART CCD area-detector diffractometer | 10221 independent reflections |
| Radiation source: fine-focus sealed tube | 8923 reflections with |
| Monochromator: graphite | |
| Detector resolution: 7.31 pixels mm-1 | θmax = 28.7º |
| θmin = 1.4º | |
| φ and ω scans | |
| Absorption correction: multi-scan(SADABS; Sheldrick, 1996) | |
| 38570 measured reflections |
| Refinement on | Secondary atom site location: difference Fourier map |
| Least-squares matrix: full | Hydrogen site location: inferred from neighbouring sites |
| H-atom parameters constrained | |
| | |
| (Δ/σ)max = 0.002 | |
| 10221 reflections | Δρmax = 1.52 e Å−3 |
| 534 parameters | Δρmin = −1.55 e Å−3 |
| Primary atom site location: structure-invariant direct methods | Extinction correction: none |
| 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 |
| Au1 | 0.638497 (12) | 0.281287 (9) | 0.032930 (4) | 0.01055 (4) | |
| Au2 | 0.566168 (12) | 0.331694 (9) | 0.152497 (4) | 0.00993 (4) | |
| Cl1 | 0.78527 (10) | 0.29051 (6) | 0.29597 (3) | 0.01996 (19) | |
| P1 | 0.60967 (9) | 0.21001 (6) | 0.10167 (3) | 0.01063 (17) | |
| O1 | 0.6459 (3) | 0.3221 (3) | 0.29088 (12) | 0.0507 (9) | |
| O2 | 0.8447 (3) | 0.3313 (2) | 0.25911 (10) | 0.0406 (8) | |
| O3 | 0.7868 (3) | 0.18429 (18) | 0.29417 (10) | 0.0324 (7) | |
| O5 | 0.8547 (3) | 0.3239 (2) | 0.33921 (10) | 0.0333 (7) | |
| N1 | 0.6406 (3) | 0.33719 (18) | −0.03039 (9) | 0.0119 (6) | |
| N2 | 0.5487 (3) | 0.44270 (18) | 0.19785 (9) | 0.0125 (6) | |
| N3 | 0.6293 (4) | 0.8322 (2) | 0.06888 (13) | 0.0353 (9) | |
| C1 | 0.8332 (3) | 0.2378 (2) | 0.02273 (12) | 0.0134 (7) | |
| C2 | 0.9377 (4) | 0.1917 (3) | 0.05082 (13) | 0.0196 (8) | |
| H2 | 0.9268 | 0.1750 | 0.0812 | 0.024* | |
| C3 | 1.0580 (4) | 0.1693 (3) | 0.03557 (14) | 0.0234 (8) | |
| H3 | 1.1276 | 0.1372 | 0.0556 | 0.028* | |
| C4 | 1.0781 (4) | 0.1929 (3) | −0.00813 (14) | 0.0227 (8) | |
| H4 | 1.1602 | 0.1759 | −0.0183 | 0.027* | |
| C5 | 0.9785 (4) | 0.2413 (3) | −0.03691 (13) | 0.0187 (8) | |
| H5 | 0.9924 | 0.2590 | −0.0669 | 0.022* | |
| C6 | 0.8559 (3) | 0.2646 (2) | −0.02188 (12) | 0.0134 (7) | |
| C7 | 0.7489 (3) | 0.3170 (2) | −0.05110 (12) | 0.0131 (7) | |
| C8 | 0.7447 (4) | 0.3461 (2) | −0.09612 (13) | 0.0189 (8) | |
| H8 | 0.8185 | 0.3328 | −0.1117 | 0.023* | |
| C9 | 0.6330 (4) | 0.3944 (3) | −0.11806 (13) | 0.0248 (9) | |
| H9 | 0.6298 | 0.4134 | −0.1491 | 0.030* | |
| C10 | 0.5247 (4) | 0.4158 (3) | −0.09585 (13) | 0.0214 (8) | |
| H10 | 0.4492 | 0.4511 | −0.1110 | 0.026* | |
| C11 | 0.5288 (3) | 0.3846 (2) | −0.05116 (12) | 0.0142 (7) | |
| C12 | 0.4238 (3) | 0.3933 (2) | −0.02224 (11) | 0.0127 (7) | |
| C13 | 0.3035 (4) | 0.4442 (2) | −0.03724 (12) | 0.0184 (7) | |
| H13 | 0.2895 | 0.4741 | −0.0666 | 0.022* | |
| C14 | 0.2057 (4) | 0.4508 (3) | −0.00958 (13) | 0.0205 (8) | |
| H14 | 0.1246 | 0.4858 | −0.0195 | 0.025* | |
| C15 | 0.2268 (4) | 0.4059 (3) | 0.03288 (13) | 0.0207 (8) | |
| H15 | 0.1593 | 0.4100 | 0.0520 | 0.025* | |
| C16 | 0.3458 (4) | 0.3546 (2) | 0.04811 (12) | 0.0173 (7) | |
| H16 | 0.3577 | 0.3238 | 0.0773 | 0.021* | |
| C17 | 0.4473 (3) | 0.3480 (2) | 0.02116 (12) | 0.0134 (7) | |
| C18 | 0.7480 (3) | 0.4054 (2) | 0.15075 (11) | 0.0134 (7) | |
| C19 | 0.8548 (3) | 0.3858 (3) | 0.12706 (12) | 0.0159 (7) | |
| H19 | 0.8515 | 0.3290 | 0.1080 | 0.019* | |
| C20 | 0.9665 (4) | 0.4483 (3) | 0.13097 (13) | 0.0233 (8) | |
| H20 | 1.0380 | 0.4332 | 0.1146 | 0.028* | |
| C21 | 0.9750 (4) | 0.5317 (3) | 0.15812 (14) | 0.0232 (8) | |
| H21 | 1.0506 | 0.5743 | 0.1599 | 0.028* | |
| C22 | 0.8716 (4) | 0.5523 (3) | 0.18275 (12) | 0.0211 (8) | |
| H22 | 0.8770 | 0.6089 | 0.2019 | 0.025* | |
| C23 | 0.7597 (3) | 0.4903 (2) | 0.17957 (12) | 0.0158 (7) | |
| C24 | 0.6487 (4) | 0.5093 (2) | 0.20564 (12) | 0.0154 (7) | |
| C25 | 0.6358 (4) | 0.5876 (2) | 0.23508 (12) | 0.0205 (8) | |
| H25 | 0.7051 | 0.6355 | 0.2416 | 0.025* | |
| C26 | 0.5196 (4) | 0.5942 (2) | 0.25476 (12) | 0.0215 (8) | |
| H26 | 0.5077 | 0.6487 | 0.2739 | 0.026* | |
| C27 | 0.4211 (4) | 0.5227 (2) | 0.24684 (12) | 0.0188 (8) | |
| H27 | 0.3433 | 0.5269 | 0.2613 | 0.023* | |
| C28 | 0.4362 (3) | 0.4449 (2) | 0.21773 (11) | 0.0135 (7) | |
| C29 | 0.3418 (3) | 0.3654 (2) | 0.20285 (12) | 0.0145 (7) | |
| C30 | 0.2188 (4) | 0.3568 (3) | 0.22005 (13) | 0.0190 (8) | |
| H30 | 0.1987 | 0.4011 | 0.2429 | 0.023* | |
| C31 | 0.1278 (4) | 0.2837 (3) | 0.20352 (13) | 0.0207 (8) | |
| H31 | 0.0463 | 0.2762 | 0.2157 | 0.025* | |
| C32 | 0.1563 (4) | 0.2214 (3) | 0.16901 (13) | 0.0202 (8) | |
| H32 | 0.0926 | 0.1727 | 0.1569 | 0.024* | |
| C33 | 0.2777 (3) | 0.2295 (2) | 0.15193 (12) | 0.0171 (7) | |
| H33 | 0.2949 | 0.1864 | 0.1282 | 0.021* | |
| C34 | 0.3738 (3) | 0.2993 (2) | 0.16887 (11) | 0.0124 (7) | |
| C35 | 0.7453 (3) | 0.1350 (2) | 0.13295 (11) | 0.0128 (7) | |
| C36 | 0.7981 (3) | 0.1545 (2) | 0.17805 (12) | 0.0139 (7) | |
| H36 | 0.7716 | 0.2125 | 0.1924 | 0.017* | |
| C37 | 0.8898 (3) | 0.0893 (2) | 0.20256 (12) | 0.0172 (7) | |
| H37 | 0.9238 | 0.1024 | 0.2337 | 0.021* | |
| C38 | 0.9313 (3) | 0.0060 (3) | 0.18167 (13) | 0.0184 (8) | |
| H38 | 0.9949 | −0.0376 | 0.1982 | 0.022* | |
| C39 | 0.8799 (4) | −0.0139 (3) | 0.13654 (13) | 0.0208 (8) | |
| H39 | 0.9095 | −0.0707 | 0.1220 | 0.025* | |
| C40 | 0.7854 (4) | 0.0489 (3) | 0.11244 (13) | 0.0204 (8) | |
| H40 | 0.7476 | 0.0334 | 0.0819 | 0.024* | |
| C41 | 0.4844 (3) | 0.1125 (2) | 0.08729 (11) | 0.0122 (7) | |
| C42 | 0.4565 (4) | 0.0507 (2) | 0.12251 (13) | 0.0215 (8) | |
| H42 | 0.5013 | 0.0611 | 0.1528 | 0.026* | |
| C43 | 0.3644 (4) | −0.0252 (3) | 0.11367 (15) | 0.0268 (9) | |
| H43 | 0.3430 | −0.0650 | 0.1380 | 0.032* | |
| C44 | 0.3032 (4) | −0.0431 (3) | 0.06923 (16) | 0.0282 (10) | |
| H44 | 0.2401 | −0.0954 | 0.0631 | 0.034* | |
| C45 | 0.3338 (4) | 0.0151 (3) | 0.03385 (14) | 0.0242 (8) | |
| H45 | 0.2940 | 0.0011 | 0.0034 | 0.029* | |
| C46 | 0.4236 (3) | 0.0948 (2) | 0.04281 (12) | 0.0155 (7) | |
| H46 | 0.4424 | 0.1361 | 0.0186 | 0.019* | |
| C47 | 0.6302 (4) | 0.8197 (3) | 0.10658 (16) | 0.0301 (10) | |
| C48 | 0.6321 (5) | 0.8047 (4) | 0.15590 (16) | 0.0448 (12) | |
| H48A | 0.6670 | 0.8642 | 0.1725 | 0.067* | |
| H48B | 0.6899 | 0.7482 | 0.1662 | 0.067* | |
| H48C | 0.5405 | 0.7916 | 0.1618 | 0.067* |
| Au1 | 0.01160 (7) | 0.01217 (6) | 0.00809 (6) | 0.00003 (5) | 0.00215 (5) | 0.00087 (4) |
| Au2 | 0.01163 (7) | 0.00982 (6) | 0.00834 (6) | −0.00009 (5) | 0.00155 (5) | −0.00021 (4) |
| Cl1 | 0.0299 (5) | 0.0169 (4) | 0.0141 (4) | −0.0020 (4) | 0.0064 (4) | −0.0008 (3) |
| P1 | 0.0135 (4) | 0.0105 (4) | 0.0080 (4) | 0.0006 (3) | 0.0019 (3) | −0.0002 (3) |
| O1 | 0.036 (2) | 0.065 (2) | 0.050 (2) | 0.0258 (17) | 0.0025 (17) | −0.0007 (18) |
| O2 | 0.068 (2) | 0.0353 (17) | 0.0223 (17) | −0.0232 (16) | 0.0181 (17) | −0.0033 (13) |
| O3 | 0.052 (2) | 0.0138 (13) | 0.0306 (18) | −0.0011 (13) | 0.0035 (15) | −0.0016 (11) |
| O5 | 0.0417 (19) | 0.0377 (17) | 0.0206 (16) | −0.0132 (14) | 0.0046 (14) | −0.0053 (13) |
| N1 | 0.0158 (15) | 0.0110 (13) | 0.0094 (14) | −0.0019 (11) | 0.0036 (12) | 0.0016 (10) |
| N2 | 0.0196 (15) | 0.0096 (12) | 0.0082 (14) | 0.0016 (12) | 0.0016 (12) | −0.0013 (10) |
| N3 | 0.052 (3) | 0.0319 (19) | 0.023 (2) | −0.0020 (18) | 0.0084 (19) | −0.0059 (15) |
| C1 | 0.0123 (17) | 0.0161 (16) | 0.0127 (17) | −0.0003 (13) | 0.0049 (14) | −0.0046 (13) |
| C2 | 0.0166 (19) | 0.0259 (19) | 0.0154 (19) | 0.0015 (15) | −0.0007 (15) | 0.0031 (15) |
| C3 | 0.018 (2) | 0.030 (2) | 0.021 (2) | 0.0035 (16) | −0.0010 (16) | −0.0006 (16) |
| C4 | 0.0126 (19) | 0.032 (2) | 0.024 (2) | 0.0026 (16) | 0.0060 (16) | −0.0055 (16) |
| C5 | 0.0176 (19) | 0.0222 (18) | 0.0174 (19) | −0.0019 (15) | 0.0063 (15) | −0.0009 (14) |
| C6 | 0.0142 (18) | 0.0123 (15) | 0.0136 (18) | −0.0023 (13) | 0.0022 (14) | −0.0010 (12) |
| C7 | 0.0164 (18) | 0.0111 (15) | 0.0122 (17) | −0.0015 (13) | 0.0035 (14) | −0.0016 (12) |
| C8 | 0.026 (2) | 0.0181 (17) | 0.0140 (19) | 0.0015 (15) | 0.0083 (16) | 0.0009 (14) |
| C9 | 0.032 (2) | 0.030 (2) | 0.014 (2) | 0.0038 (18) | 0.0091 (17) | 0.0079 (16) |
| C10 | 0.029 (2) | 0.0221 (18) | 0.0139 (19) | 0.0071 (16) | 0.0040 (16) | 0.0076 (14) |
| C11 | 0.0203 (18) | 0.0089 (15) | 0.0127 (18) | −0.0018 (13) | 0.0004 (14) | 0.0021 (12) |
| C12 | 0.0162 (18) | 0.0103 (15) | 0.0111 (17) | −0.0010 (13) | 0.0003 (14) | 0.0001 (12) |
| C13 | 0.0211 (19) | 0.0169 (16) | 0.0164 (19) | −0.0007 (15) | 0.0002 (15) | 0.0039 (14) |
| C14 | 0.0180 (19) | 0.0204 (18) | 0.023 (2) | 0.0064 (15) | 0.0015 (16) | 0.0034 (15) |
| C15 | 0.0155 (19) | 0.0259 (19) | 0.022 (2) | 0.0023 (15) | 0.0072 (16) | −0.0017 (15) |
| C16 | 0.0186 (19) | 0.0216 (17) | 0.0112 (18) | 0.0016 (15) | 0.0008 (14) | 0.0029 (13) |
| C17 | 0.0134 (17) | 0.0121 (15) | 0.0151 (18) | 0.0019 (13) | 0.0034 (14) | 0.0002 (13) |
| C18 | 0.0132 (17) | 0.0153 (16) | 0.0103 (17) | −0.0020 (13) | −0.0026 (13) | 0.0045 (13) |
| C19 | 0.0131 (17) | 0.0194 (17) | 0.0147 (18) | 0.0002 (14) | 0.0001 (14) | 0.0009 (14) |
| C20 | 0.018 (2) | 0.032 (2) | 0.020 (2) | −0.0012 (17) | 0.0048 (16) | 0.0053 (16) |
| C21 | 0.0145 (19) | 0.027 (2) | 0.027 (2) | −0.0088 (16) | −0.0008 (16) | 0.0053 (16) |
| C22 | 0.028 (2) | 0.0164 (17) | 0.017 (2) | −0.0059 (16) | −0.0027 (16) | 0.0020 (14) |
| C23 | 0.0172 (18) | 0.0145 (16) | 0.0145 (18) | −0.0003 (14) | −0.0013 (14) | 0.0035 (13) |
| C24 | 0.0219 (19) | 0.0123 (15) | 0.0098 (17) | −0.0021 (14) | −0.0045 (14) | 0.0009 (12) |
| C25 | 0.031 (2) | 0.0137 (16) | 0.0152 (19) | −0.0057 (15) | −0.0004 (16) | −0.0037 (13) |
| C26 | 0.039 (2) | 0.0150 (17) | 0.0103 (18) | 0.0040 (16) | 0.0026 (17) | −0.0039 (13) |
| C27 | 0.026 (2) | 0.0168 (17) | 0.0143 (19) | 0.0075 (15) | 0.0049 (16) | −0.0001 (13) |
| C28 | 0.0166 (18) | 0.0138 (15) | 0.0100 (17) | 0.0046 (14) | 0.0016 (14) | 0.0006 (13) |
| C29 | 0.0154 (18) | 0.0160 (16) | 0.0116 (17) | 0.0027 (14) | 0.0008 (14) | 0.0036 (13) |
| C30 | 0.0187 (19) | 0.0213 (18) | 0.019 (2) | 0.0076 (15) | 0.0076 (16) | 0.0000 (14) |
| C31 | 0.0130 (18) | 0.029 (2) | 0.021 (2) | 0.0020 (15) | 0.0049 (15) | 0.0052 (16) |
| C32 | 0.0130 (18) | 0.0248 (19) | 0.022 (2) | −0.0003 (15) | 0.0016 (15) | 0.0050 (15) |
| C33 | 0.0154 (18) | 0.0188 (17) | 0.0165 (19) | 0.0022 (14) | 0.0001 (15) | −0.0004 (14) |
| C34 | 0.0146 (17) | 0.0144 (15) | 0.0081 (16) | 0.0001 (13) | 0.0019 (13) | 0.0029 (12) |
| C35 | 0.0154 (17) | 0.0130 (15) | 0.0104 (17) | 0.0010 (13) | 0.0033 (14) | 0.0030 (12) |
| C36 | 0.0113 (17) | 0.0159 (16) | 0.0151 (18) | −0.0001 (13) | 0.0034 (14) | 0.0010 (13) |
| C37 | 0.0122 (17) | 0.0244 (18) | 0.0143 (19) | −0.0003 (14) | −0.0001 (14) | 0.0054 (14) |
| C38 | 0.0141 (18) | 0.0191 (17) | 0.023 (2) | 0.0032 (14) | 0.0062 (15) | 0.0063 (14) |
| C39 | 0.025 (2) | 0.0153 (17) | 0.024 (2) | 0.0075 (15) | 0.0075 (17) | −0.0007 (14) |
| C40 | 0.023 (2) | 0.0201 (18) | 0.017 (2) | 0.0035 (15) | −0.0011 (15) | −0.0027 (14) |
| C41 | 0.0136 (17) | 0.0104 (15) | 0.0131 (17) | −0.0016 (13) | 0.0034 (14) | −0.0030 (12) |
| C42 | 0.029 (2) | 0.0169 (17) | 0.020 (2) | −0.0023 (16) | 0.0071 (17) | 0.0006 (15) |
| C43 | 0.031 (2) | 0.0155 (18) | 0.037 (3) | −0.0063 (16) | 0.015 (2) | 0.0023 (16) |
| C44 | 0.022 (2) | 0.0159 (18) | 0.048 (3) | −0.0069 (16) | 0.009 (2) | −0.0033 (17) |
| C45 | 0.020 (2) | 0.0223 (19) | 0.028 (2) | −0.0004 (16) | −0.0060 (16) | −0.0089 (16) |
| C46 | 0.0137 (18) | 0.0177 (16) | 0.0149 (18) | 0.0008 (14) | 0.0019 (14) | −0.0018 (13) |
| C47 | 0.040 (3) | 0.0199 (19) | 0.031 (3) | 0.0015 (18) | 0.006 (2) | −0.0050 (17) |
| C48 | 0.062 (3) | 0.046 (3) | 0.027 (3) | −0.001 (3) | 0.008 (2) | 0.008 (2) |
| Au1—N1 | 2.027 (3) | C20—C21 | 1.380 (5) |
| Au1—C17 | 2.105 (3) | C20—H20 | 0.9500 |
| Au1—C1 | 2.111 (3) | C21—C22 | 1.388 (5) |
| Au1—P1 | 2.3121 (9) | C21—H21 | 0.9500 |
| Au2—N2 | 2.041 (3) | C22—C23 | 1.395 (5) |
| Au2—C18 | 2.091 (3) | C22—H22 | 0.9500 |
| Au2—C34 | 2.113 (3) | C23—C24 | 1.474 (5) |
| Au2—P1 | 2.3180 (8) | C24—C25 | 1.391 (4) |
| Cl1—O2 | 1.434 (3) | C25—C26 | 1.387 (5) |
| Cl1—O5 | 1.436 (3) | C25—H25 | 0.9500 |
| Cl1—O3 | 1.438 (3) | C26—C27 | 1.378 (5) |
| Cl1—O1 | 1.451 (3) | C26—H26 | 0.9500 |
| P1—C41 | 1.829 (3) | C27—C28 | 1.384 (4) |
| P1—C35 | 1.833 (3) | C27—H27 | 0.9500 |
| N1—C11 | 1.357 (4) | C28—C29 | 1.458 (5) |
| N1—C7 | 1.358 (4) | C29—C30 | 1.413 (4) |
| N2—C24 | 1.344 (4) | C29—C34 | 1.421 (4) |
| N2—C28 | 1.354 (4) | C30—C31 | 1.386 (5) |
| N3—C47 | 1.129 (5) | C30—H30 | 0.9500 |
| C1—C2 | 1.385 (5) | C31—C32 | 1.389 (5) |
| C1—C6 | 1.423 (5) | C31—H31 | 0.9500 |
| C2—C3 | 1.389 (5) | C32—C33 | 1.396 (5) |
| C2—H2 | 0.9500 | C32—H32 | 0.9500 |
| C3—C4 | 1.379 (5) | C33—C34 | 1.389 (5) |
| C3—H3 | 0.9500 | C33—H33 | 0.9500 |
| C4—C5 | 1.379 (5) | C35—C36 | 1.386 (5) |
| C4—H4 | 0.9500 | C35—C40 | 1.402 (4) |
| C5—C6 | 1.409 (4) | C36—C37 | 1.397 (5) |
| C5—H5 | 0.9500 | C36—H36 | 0.9500 |
| C6—C7 | 1.457 (5) | C37—C38 | 1.382 (5) |
| C7—C8 | 1.386 (5) | C37—H37 | 0.9500 |
| C8—C9 | 1.374 (5) | C38—C39 | 1.385 (5) |
| C8—H8 | 0.9500 | C38—H38 | 0.9500 |
| C9—C10 | 1.387 (5) | C39—C40 | 1.389 (5) |
| C9—H9 | 0.9500 | C39—H39 | 0.9500 |
| C10—C11 | 1.384 (5) | C40—H40 | 0.9500 |
| C10—H10 | 0.9500 | C41—C46 | 1.387 (5) |
| C11—C12 | 1.464 (4) | C41—C42 | 1.399 (4) |
| C12—C13 | 1.404 (5) | C42—C43 | 1.382 (5) |
| C12—C17 | 1.412 (4) | C42—H42 | 0.9500 |
| C13—C14 | 1.377 (5) | C43—C44 | 1.387 (6) |
| C13—H13 | 0.9500 | C43—H43 | 0.9500 |
| C14—C15 | 1.384 (5) | C44—C45 | 1.383 (5) |
| C14—H14 | 0.9500 | C44—H44 | 0.9500 |
| C15—C16 | 1.397 (5) | C45—C46 | 1.405 (5) |
| C15—H15 | 0.9500 | C45—H45 | 0.9500 |
| C16—C17 | 1.392 (4) | C46—H46 | 0.9500 |
| C16—H16 | 0.9500 | C47—C48 | 1.473 (6) |
| C18—C19 | 1.397 (4) | C48—H48A | 0.9800 |
| C18—C23 | 1.425 (5) | C48—H48B | 0.9800 |
| C19—C20 | 1.397 (5) | C48—H48C | 0.9800 |
| C19—H19 | 0.9500 | ||
| N1—Au1—C17 | 79.97 (12) | C21—C20—H20 | 119.3 |
| N1—Au1—C1 | 80.18 (12) | C19—C20—H20 | 119.3 |
| C17—Au1—C1 | 160.10 (13) | C20—C21—C22 | 119.1 (3) |
| N1—Au1—P1 | 172.84 (8) | C20—C21—H21 | 120.5 |
| C17—Au1—P1 | 95.15 (9) | C22—C21—H21 | 120.5 |
| C1—Au1—P1 | 104.75 (10) | C21—C22—C23 | 120.4 (3) |
| N2—Au2—C18 | 80.19 (12) | C21—C22—H22 | 119.8 |
| N2—Au2—C34 | 80.02 (12) | C23—C22—H22 | 119.8 |
| C18—Au2—C34 | 160.15 (13) | C22—C23—C18 | 121.1 (3) |
| N2—Au2—P1 | 173.99 (8) | C22—C23—C24 | 121.9 (3) |
| C18—Au2—P1 | 93.98 (9) | C18—C23—C24 | 117.1 (3) |
| C34—Au2—P1 | 105.84 (9) | N2—C24—C25 | 118.6 (3) |
| O2—Cl1—O5 | 110.88 (18) | N2—C24—C23 | 113.6 (3) |
| O2—Cl1—O3 | 110.39 (17) | C25—C24—C23 | 127.8 (3) |
| O5—Cl1—O3 | 109.96 (18) | C26—C25—C24 | 118.6 (3) |
| O2—Cl1—O1 | 108.4 (2) | C26—C25—H25 | 120.7 |
| O5—Cl1—O1 | 109.28 (19) | C24—C25—H25 | 120.7 |
| O3—Cl1—O1 | 107.8 (2) | C27—C26—C25 | 120.9 (3) |
| C41—P1—C35 | 98.71 (15) | C27—C26—H26 | 119.6 |
| C41—P1—Au1 | 105.69 (11) | C25—C26—H26 | 119.6 |
| C35—P1—Au1 | 119.48 (10) | C26—C27—C28 | 119.7 (3) |
| C41—P1—Au2 | 118.14 (10) | C26—C27—H27 | 120.2 |
| C35—P1—Au2 | 105.32 (11) | C28—C27—H27 | 120.2 |
| Au1—P1—Au2 | 109.78 (3) | N2—C28—C27 | 117.8 (3) |
| C11—N1—C7 | 123.8 (3) | N2—C28—C29 | 113.7 (3) |
| C11—N1—Au1 | 118.1 (2) | C27—C28—C29 | 128.4 (3) |
| C7—N1—Au1 | 117.8 (2) | C30—C29—C34 | 120.7 (3) |
| C24—N2—C28 | 124.4 (3) | C30—C29—C28 | 121.2 (3) |
| C24—N2—Au2 | 117.9 (2) | C34—C29—C28 | 118.1 (3) |
| C28—N2—Au2 | 117.7 (2) | C31—C30—C29 | 119.9 (3) |
| C2—C1—C6 | 117.3 (3) | C31—C30—H30 | 120.0 |
| C2—C1—Au1 | 132.4 (3) | C29—C30—H30 | 120.0 |
| C6—C1—Au1 | 110.3 (2) | C30—C31—C32 | 119.6 (3) |
| C1—C2—C3 | 121.4 (3) | C30—C31—H31 | 120.2 |
| C1—C2—H2 | 119.3 | C32—C31—H31 | 120.2 |
| C3—C2—H2 | 119.3 | C31—C32—C33 | 120.7 (3) |
| C4—C3—C2 | 121.1 (4) | C31—C32—H32 | 119.7 |
| C4—C3—H3 | 119.5 | C33—C32—H32 | 119.7 |
| C2—C3—H3 | 119.5 | C34—C33—C32 | 121.5 (3) |
| C5—C4—C3 | 119.6 (3) | C34—C33—H33 | 119.3 |
| C5—C4—H4 | 120.2 | C32—C33—H33 | 119.3 |
| C3—C4—H4 | 120.2 | C33—C34—C29 | 117.6 (3) |
| C4—C5—C6 | 120.0 (3) | C33—C34—Au2 | 132.0 (2) |
| C4—C5—H5 | 120.0 | C29—C34—Au2 | 110.3 (2) |
| C6—C5—H5 | 120.0 | C36—C35—C40 | 118.9 (3) |
| C5—C6—C1 | 120.6 (3) | C36—C35—P1 | 121.9 (2) |
| C5—C6—C7 | 121.5 (3) | C40—C35—P1 | 118.8 (3) |
| C1—C6—C7 | 117.8 (3) | C35—C36—C37 | 120.5 (3) |
| N1—C7—C8 | 118.0 (3) | C35—C36—H36 | 119.8 |
| N1—C7—C6 | 113.6 (3) | C37—C36—H36 | 119.8 |
| C8—C7—C6 | 128.4 (3) | C38—C37—C36 | 120.2 (3) |
| C9—C8—C7 | 119.5 (3) | C38—C37—H37 | 119.9 |
| C9—C8—H8 | 120.2 | C36—C37—H37 | 119.9 |
| C7—C8—H8 | 120.2 | C37—C38—C39 | 119.9 (3) |
| C8—C9—C10 | 121.3 (3) | C37—C38—H38 | 120.1 |
| C8—C9—H9 | 119.3 | C39—C38—H38 | 120.1 |
| C10—C9—H9 | 119.3 | C38—C39—C40 | 120.2 (3) |
| C11—C10—C9 | 118.7 (3) | C38—C39—H39 | 119.9 |
| C11—C10—H10 | 120.7 | C40—C39—H39 | 119.9 |
| C9—C10—H10 | 120.7 | C39—C40—C35 | 120.4 (3) |
| N1—C11—C10 | 118.6 (3) | C39—C40—H40 | 119.8 |
| N1—C11—C12 | 113.2 (3) | C35—C40—H40 | 119.8 |
| C10—C11—C12 | 128.1 (3) | C46—C41—C42 | 119.8 (3) |
| C13—C12—C17 | 121.2 (3) | C46—C41—P1 | 122.3 (3) |
| C13—C12—C11 | 121.2 (3) | C42—C41—P1 | 117.8 (3) |
| C17—C12—C11 | 117.6 (3) | C43—C42—C41 | 120.6 (4) |
| C14—C13—C12 | 120.2 (3) | C43—C42—H42 | 119.7 |
| C14—C13—H13 | 119.9 | C41—C42—H42 | 119.7 |
| C12—C13—H13 | 119.9 | C42—C43—C44 | 119.8 (4) |
| C13—C14—C15 | 119.2 (3) | C42—C43—H43 | 120.1 |
| C13—C14—H14 | 120.4 | C44—C43—H43 | 120.1 |
| C15—C14—H14 | 120.4 | C45—C44—C43 | 120.2 (3) |
| C14—C15—C16 | 121.1 (3) | C45—C44—H44 | 119.9 |
| C14—C15—H15 | 119.5 | C43—C44—H44 | 119.9 |
| C16—C15—H15 | 119.5 | C44—C45—C46 | 120.3 (4) |
| C17—C16—C15 | 120.9 (3) | C44—C45—H45 | 119.8 |
| C17—C16—H16 | 119.5 | C46—C45—H45 | 119.8 |
| C15—C16—H16 | 119.5 | C41—C46—C45 | 119.3 (3) |
| C16—C17—C12 | 117.4 (3) | C41—C46—H46 | 120.3 |
| C16—C17—Au1 | 131.6 (3) | C45—C46—H46 | 120.3 |
| C12—C17—Au1 | 111.0 (2) | N3—C47—C48 | 179.2 (5) |
| C19—C18—C23 | 117.1 (3) | C47—C48—H48A | 109.5 |
| C19—C18—Au2 | 131.7 (3) | C47—C48—H48B | 109.5 |
| C23—C18—Au2 | 111.2 (2) | H48A—C48—H48B | 109.5 |
| C18—C19—C20 | 120.9 (3) | C47—C48—H48C | 109.5 |
| C18—C19—H19 | 119.5 | H48A—C48—H48C | 109.5 |
| C20—C19—H19 | 119.5 | H48B—C48—H48C | 109.5 |
| C21—C20—C19 | 121.4 (3) | ||
| C17—Au1—P1—C41 | 69.65 (14) | C34—Au2—C18—C23 | 3.3 (5) |
| C1—Au1—P1—C41 | −109.99 (14) | P1—Au2—C18—C23 | 179.9 (2) |
| C17—Au1—P1—C35 | 179.50 (16) | C23—C18—C19—C20 | −1.3 (5) |
| C1—Au1—P1—C35 | −0.14 (16) | Au2—C18—C19—C20 | 178.8 (3) |
| C17—Au1—P1—Au2 | −58.78 (10) | C18—C19—C20—C21 | −0.2 (6) |
| C1—Au1—P1—Au2 | 121.58 (10) | C19—C20—C21—C22 | 1.4 (6) |
| C18—Au2—P1—C41 | 179.02 (15) | C20—C21—C22—C23 | −0.9 (6) |
| C34—Au2—P1—C41 | −2.15 (16) | C21—C22—C23—C18 | −0.7 (5) |
| C18—Au2—P1—C35 | 70.08 (14) | C21—C22—C23—C24 | 179.3 (3) |
| C34—Au2—P1—C35 | −111.09 (14) | C19—C18—C23—C22 | 1.8 (5) |
| C18—Au2—P1—Au1 | −59.77 (9) | Au2—C18—C23—C22 | −178.3 (3) |
| C34—Au2—P1—Au1 | 119.07 (10) | C19—C18—C23—C24 | −178.2 (3) |
| C17—Au1—N1—C11 | −2.2 (2) | Au2—C18—C23—C24 | 1.7 (4) |
| C1—Au1—N1—C11 | 179.3 (3) | C28—N2—C24—C25 | −1.7 (5) |
| C17—Au1—N1—C7 | −176.2 (3) | Au2—N2—C24—C25 | 177.5 (2) |
| C1—Au1—N1—C7 | 5.3 (2) | C28—N2—C24—C23 | −179.8 (3) |
| C18—Au2—N2—C24 | 1.2 (2) | Au2—N2—C24—C23 | −0.6 (4) |
| C34—Au2—N2—C24 | −177.2 (3) | C22—C23—C24—N2 | 179.2 (3) |
| C18—Au2—N2—C28 | −179.5 (3) | C18—C23—C24—N2 | −0.8 (4) |
| C34—Au2—N2—C28 | 2.1 (2) | C22—C23—C24—C25 | 1.3 (6) |
| N1—Au1—C1—C2 | 175.4 (4) | C18—C23—C24—C25 | −178.7 (3) |
| C17—Au1—C1—C2 | 171.1 (3) | N2—C24—C25—C26 | −0.7 (5) |
| P1—Au1—C1—C2 | −9.9 (4) | C23—C24—C25—C26 | 177.0 (3) |
| N1—Au1—C1—C6 | −3.4 (2) | C24—C25—C26—C27 | 2.6 (5) |
| C17—Au1—C1—C6 | −7.7 (5) | C25—C26—C27—C28 | −2.1 (5) |
| P1—Au1—C1—C6 | 171.3 (2) | C24—N2—C28—C27 | 2.2 (5) |
| C6—C1—C2—C3 | −2.3 (5) | Au2—N2—C28—C27 | −177.0 (2) |
| Au1—C1—C2—C3 | 179.0 (3) | C24—N2—C28—C29 | 178.8 (3) |
| C1—C2—C3—C4 | 0.5 (6) | Au2—N2—C28—C29 | −0.4 (4) |
| C2—C3—C4—C5 | 1.3 (6) | C26—C27—C28—N2 | −0.2 (5) |
| C3—C4—C5—C6 | −1.3 (6) | C26—C27—C28—C29 | −176.3 (3) |
| C4—C5—C6—C1 | −0.6 (5) | N2—C28—C29—C30 | −179.8 (3) |
| C4—C5—C6—C7 | 179.2 (3) | C27—C28—C29—C30 | −3.6 (6) |
| C2—C1—C6—C5 | 2.3 (5) | N2—C28—C29—C34 | −2.7 (4) |
| Au1—C1—C6—C5 | −178.7 (3) | C27—C28—C29—C34 | 173.5 (3) |
| C2—C1—C6—C7 | −177.5 (3) | C34—C29—C30—C31 | −0.5 (5) |
| Au1—C1—C6—C7 | 1.5 (4) | C28—C29—C30—C31 | 176.6 (3) |
| C11—N1—C7—C8 | −0.3 (5) | C29—C30—C31—C32 | −2.1 (6) |
| Au1—N1—C7—C8 | 173.4 (2) | C30—C31—C32—C33 | 2.2 (6) |
| C11—N1—C7—C6 | −179.5 (3) | C31—C32—C33—C34 | 0.4 (6) |
| Au1—N1—C7—C6 | −5.8 (4) | C32—C33—C34—C29 | −2.9 (5) |
| C5—C6—C7—N1 | −177.2 (3) | C32—C33—C34—Au2 | 179.1 (3) |
| C1—C6—C7—N1 | 2.6 (4) | C30—C29—C34—C33 | 2.9 (5) |
| C5—C6—C7—C8 | 3.8 (5) | C28—C29—C34—C33 | −174.2 (3) |
| C1—C6—C7—C8 | −176.5 (3) | C30—C29—C34—Au2 | −178.7 (3) |
| N1—C7—C8—C9 | 0.3 (5) | C28—C29—C34—Au2 | 4.2 (4) |
| C6—C7—C8—C9 | 179.4 (3) | N2—Au2—C34—C33 | 174.9 (3) |
| C7—C8—C9—C10 | 0.9 (6) | C18—Au2—C34—C33 | 170.1 (3) |
| C8—C9—C10—C11 | −2.2 (6) | P1—Au2—C34—C33 | −6.5 (3) |
| C7—N1—C11—C10 | −1.0 (5) | N2—Au2—C34—C29 | −3.3 (2) |
| Au1—N1—C11—C10 | −174.6 (2) | C18—Au2—C34—C29 | −8.1 (5) |
| C7—N1—C11—C12 | 177.3 (3) | P1—Au2—C34—C29 | 175.4 (2) |
| Au1—N1—C11—C12 | 3.7 (4) | C41—P1—C35—C36 | −120.8 (3) |
| C9—C10—C11—N1 | 2.2 (5) | Au1—P1—C35—C36 | 125.5 (2) |
| C9—C10—C11—C12 | −175.8 (3) | Au2—P1—C35—C36 | 1.6 (3) |
| N1—C11—C12—C13 | 177.0 (3) | C41—P1—C35—C40 | 51.5 (3) |
| C10—C11—C12—C13 | −4.9 (6) | Au1—P1—C35—C40 | −62.2 (3) |
| N1—C11—C12—C17 | −3.5 (4) | Au2—P1—C35—C40 | 173.9 (2) |
| C10—C11—C12—C17 | 174.6 (3) | C40—C35—C36—C37 | 0.1 (5) |
| C17—C12—C13—C14 | 0.1 (5) | P1—C35—C36—C37 | 172.4 (2) |
| C11—C12—C13—C14 | 179.6 (3) | C35—C36—C37—C38 | 1.5 (5) |
| C12—C13—C14—C15 | −0.7 (5) | C36—C37—C38—C39 | −1.1 (5) |
| C13—C14—C15—C16 | 0.4 (6) | C37—C38—C39—C40 | −1.0 (5) |
| C14—C15—C16—C17 | 0.6 (6) | C38—C39—C40—C35 | 2.7 (5) |
| C15—C16—C17—C12 | −1.2 (5) | C36—C35—C40—C39 | −2.2 (5) |
| C15—C16—C17—Au1 | 178.4 (3) | P1—C35—C40—C39 | −174.7 (3) |
| C13—C12—C17—C16 | 0.9 (5) | C35—P1—C41—C46 | −125.9 (3) |
| C11—C12—C17—C16 | −178.6 (3) | Au1—P1—C41—C46 | −1.8 (3) |
| C13—C12—C17—Au1 | −178.8 (3) | Au2—P1—C41—C46 | 121.4 (3) |
| C11—C12—C17—Au1 | 1.7 (4) | C35—P1—C41—C42 | 50.2 (3) |
| N1—Au1—C17—C16 | −179.4 (3) | Au1—P1—C41—C42 | 174.3 (2) |
| C1—Au1—C17—C16 | −175.2 (3) | Au2—P1—C41—C42 | −62.4 (3) |
| P1—Au1—C17—C16 | 5.8 (3) | C46—C41—C42—C43 | −2.8 (5) |
| N1—Au1—C17—C12 | 0.2 (2) | P1—C41—C42—C43 | −179.0 (3) |
| C1—Au1—C17—C12 | 4.4 (5) | C41—C42—C43—C44 | 2.8 (5) |
| P1—Au1—C17—C12 | −174.6 (2) | C42—C43—C44—C45 | −0.3 (6) |
| N2—Au2—C18—C19 | 178.4 (3) | C43—C44—C45—C46 | −2.2 (6) |
| C34—Au2—C18—C19 | −176.8 (3) | C42—C41—C46—C45 | 0.4 (5) |
| P1—Au2—C18—C19 | −0.1 (3) | P1—C41—C46—C45 | 176.4 (2) |
| N2—Au2—C18—C23 | −1.5 (2) | C44—C45—C46—C41 | 2.1 (5) |
| H··· | ||||
| C21—H21···O3i | 0.95 | 2.46 | 3.311 (7) | 149 |
| C36—H36···O2 | 0.95 | 2.57 | 3.372 (8) | 143 |
| C38—H38···O2ii | 0.95 | 2.59 | 3.540 (5) | 175 |
| C43—H43···O1iii | 0.95 | 2.59 | 3.517 (3) | 165 |
| C46—H46···N3iv | 0.95 | 2.62 | 3.417 (4) | 142 |
| C48—H48C···O1v | 0.98 | 2.54 | 3.423 (8) | 150 |
| Au1—N1 | 2.027 (3) |
| Au1—C17 | 2.105 (3) |
| Au1—C1 | 2.111 (3) |
| Au1—P1 | 2.3121 (9) |
| Au2—N2 | 2.041 (3) |
| Au2—C18 | 2.091 (3) |
| Au2—C34 | 2.113 (3) |
| Au2—P1 | 2.3180 (8) |
| N1—Au1—C17 | 79.97 (12) |
| N1—Au1—C1 | 80.18 (12) |
| C17—Au1—C1 | 160.10 (13) |
| N1—Au1—P1 | 172.84 (8) |
| C17—Au1—P1 | 95.15 (9) |
| C1—Au1—P1 | 104.75 (10) |
| N2—Au2—C18 | 80.19 (12) |
| N2—Au2—C34 | 80.02 (12) |
| C18—Au2—C34 | 160.15 (13) |
| N2—Au2—P1 | 173.99 (8) |
| C18—Au2—P1 | 93.98 (9) |
| C34—Au2—P1 | 105.84 (9) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| C21—H21⋯O3i | 0.95 | 2.46 | 3.311 (7) | 149 |
| C36—H36⋯O2 | 0.95 | 2.57 | 3.372 (8) | 143 |
| C38—H38⋯O2ii | 0.95 | 2.59 | 3.540 (5) | 175 |
| C43—H43⋯O1iii | 0.95 | 2.59 | 3.517 (3) | 165 |
| C46—H46⋯N3iv | 0.95 | 2.62 | 3.417 (4) | 142 |
| C48—H48 | 0.98 | 2.54 | 3.423 (8) | 150 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) ; (v) .