| Literature DB >> 22219773 |
Yu-Hang Jiang, Li-Na Cui, Xu Huang, Qiong-Hua Jin, Cun-Lin Zhang.
Abstract
The asymmetric unit of the title compound, [Ag(C(5)H(8)N(4))(3)](CF(3)O(3)S)·C(5)H(8)N(4), contains two cations, two anions and two uncoordinated 3-amino-5,6-dimethyl-1,2,4-triazine (admt) ligands. It was prepared from the reaction of silver trifluoro-methane-sulfonate and admt in a 2:3 molar ratio. Both silver(I) ions are bonded to three admt mol-ecules via their 2-position triazine N atoms in almost regular trigonal-planar geometries. Three intra-molecular N-H⋯N hydrogen bonds between adjacent admt mol-ecules in each cation help to maintain their overall near planarities (r.m.s. deviations for the 28 non-H atoms = 0.139 and 0.153 Å). In the crystal, numerous N-H⋯N, N-H⋯O, C-H⋯O, C-H⋯N and C-H⋯F hydrogen-bonding interactions link the components into a three-dimensional network.Entities:
Year: 2011 PMID: 22219773 PMCID: PMC3246953 DOI: 10.1107/S1600536811040748
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ag(C5H8N4)3](CF3O3S)·C5H8N4 | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 2772 reflections | |
| θ = 2.7–20.9° | |
| µ = 0.77 mm−1 | |
| α = 76.735 (1)° | |
| β = 72.565 (1)° | Prism, yellow |
| γ = 81.201 (2)° | 0.45 × 0.27 × 0.23 mm |
| Bruker SMART CCD diffractometer | 11051 independent reflections |
| Radiation source: fine-focus sealed tube | 4939 reflections with |
| graphite | |
| φ and ω scans | θmax = 25.0°, θmin = 2.6° |
| Absorption correction: multi-scan ( | |
| 16692 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 | |
| 11051 reflections | (Δ/σ)max = 0.001 |
| 827 parameters | Δρmax = 0.91 e Å−3 |
| 0 restraints | Δρmin = −0.62 e Å−3 |
| Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes. |
| Refinement. Refinement of |
| Ag1 | 0.85834 (6) | 0.57530 (4) | 0.44760 (4) | 0.0605 (3) | |
| Ag2 | 0.62635 (6) | 0.57511 (4) | 0.39966 (4) | 0.0590 (3) | |
| F1 | 0.3350 (8) | −0.0570 (6) | 0.2406 (5) | 0.163 (4) | |
| F2 | 0.2818 (8) | 0.0807 (7) | 0.2091 (6) | 0.190 (5) | |
| F3 | 0.4294 (9) | 0.0428 (6) | 0.1604 (6) | 0.195 (5) | |
| F4 | 0.7901 (9) | 0.1723 (6) | 0.0993 (7) | 0.198 (5) | |
| F5 | 0.8296 (10) | 0.2132 (7) | −0.0413 (7) | 0.211 (5) | |
| F6 | 0.9350 (11) | 0.1606 (7) | 0.0250 (7) | 0.236 (7) | |
| N1 | 0.9816 (5) | 0.4714 (5) | 0.3048 (5) | 0.0559 (19) | |
| N2 | 0.9583 (5) | 0.4562 (5) | 0.3925 (4) | 0.0520 (19) | |
| N3 | 1.0454 (5) | 0.3090 (5) | 0.3950 (5) | 0.058 (2) | |
| N4 | 0.9681 (5) | 0.3603 (4) | 0.5234 (4) | 0.059 (2) | |
| H4A | 0.9343 | 0.4018 | 0.5516 | 0.071* | |
| H4B | 0.9878 | 0.3089 | 0.5517 | 0.071* | |
| N5 | 0.8133 (5) | 0.4731 (4) | 0.6360 (4) | 0.0486 (18) | |
| N6 | 0.7866 (5) | 0.5570 (4) | 0.5936 (4) | 0.0492 (18) | |
| N7 | 0.7011 (5) | 0.5999 (5) | 0.7311 (4) | 0.0513 (19) | |
| N8 | 0.7078 (5) | 0.7007 (5) | 0.6006 (4) | 0.0558 (19) | |
| H8A | 0.7279 | 0.7150 | 0.5441 | 0.067* | |
| H8B | 0.6725 | 0.7403 | 0.6306 | 0.067* | |
| N9 | 0.7701 (6) | 0.7679 (5) | 0.3997 (5) | 0.063 (2) | |
| N10 | 0.8303 (5) | 0.7047 (5) | 0.3552 (4) | 0.0539 (19) | |
| N11 | 0.8486 (6) | 0.8106 (6) | 0.2206 (5) | 0.066 (2) | |
| N12 | 0.9279 (6) | 0.6665 (5) | 0.2261 (5) | 0.070 (2) | |
| H12A | 0.9532 | 0.6794 | 0.1699 | 0.084* | |
| H12B | 0.9414 | 0.6134 | 0.2551 | 0.084* | |
| N13 | 0.7109 (6) | 0.6255 (5) | 0.2021 (4) | 0.061 (2) | |
| N14 | 0.6504 (6) | 0.6667 (5) | 0.2660 (4) | 0.0538 (19) | |
| N15 | 0.6378 (6) | 0.8034 (5) | 0.1625 (5) | 0.068 (2) | |
| N16 | 0.5526 (6) | 0.7949 (5) | 0.3078 (5) | 0.067 (2) | |
| H16A | 0.5299 | 0.8508 | 0.2950 | 0.081* | |
| H16B | 0.5357 | 0.7654 | 0.3612 | 0.081* | |
| N17 | 0.5076 (5) | 0.7193 (5) | 0.5054 (4) | 0.0526 (19) | |
| N18 | 0.5390 (5) | 0.6308 (4) | 0.5218 (4) | 0.0443 (17) | |
| N19 | 0.4663 (5) | 0.6253 (5) | 0.6749 (4) | 0.0463 (17) | |
| N20 | 0.5450 (5) | 0.4976 (4) | 0.6228 (4) | 0.0516 (19) | |
| H20A | 0.5766 | 0.4694 | 0.5807 | 0.062* | |
| H20B | 0.5312 | 0.4684 | 0.6765 | 0.062* | |
| N21 | 0.6949 (5) | 0.3913 (5) | 0.4975 (4) | 0.0482 (18) | |
| N22 | 0.7082 (5) | 0.4332 (4) | 0.4127 (4) | 0.0491 (18) | |
| N23 | 0.8044 (5) | 0.2997 (5) | 0.3675 (5) | 0.0542 (19) | |
| N24 | 0.7741 (5) | 0.4263 (5) | 0.2654 (4) | 0.061 (2) | |
| H24A | 0.8071 | 0.3974 | 0.2242 | 0.074* | |
| H24B | 0.7483 | 0.4812 | 0.2523 | 0.074* | |
| N25 | 0.4412 (6) | 0.6771 (6) | 0.1733 (5) | 0.070 (2) | |
| N26 | 0.4880 (6) | 0.5936 (6) | 0.1872 (4) | 0.064 (2) | |
| N27 | 0.5599 (6) | 0.6042 (6) | 0.0330 (5) | 0.074 (2) | |
| N28 | 0.5937 (6) | 0.4778 (6) | 0.1324 (5) | 0.085 (3) | |
| H28A | 0.5871 | 0.4474 | 0.1852 | 0.102* | |
| H28B | 0.6315 | 0.4549 | 0.0884 | 0.102* | |
| N29 | 1.0542 (8) | 0.8444 (7) | 0.3046 (7) | 0.095 (3) | |
| N30 | 1.0023 (7) | 0.8291 (6) | 0.3872 (7) | 0.086 (3) | |
| N31 | 0.9240 (7) | 0.9816 (6) | 0.3714 (7) | 0.092 (3) | |
| N32 | 0.8858 (7) | 0.8821 (6) | 0.5052 (6) | 0.099 (3) | |
| H32A | 0.8434 | 0.9241 | 0.5267 | 0.119* | |
| H32B | 0.8937 | 0.8298 | 0.5381 | 0.119* | |
| O1 | 0.3892 (7) | 0.1421 (5) | 0.3072 (5) | 0.115 (3) | |
| O2 | 0.2964 (7) | 0.0192 (6) | 0.3926 (5) | 0.139 (3) | |
| O3 | 0.4723 (7) | −0.0104 (5) | 0.3231 (6) | 0.129 (3) | |
| O4 | 0.8797 (9) | 0.3176 (7) | 0.1157 (6) | 0.169 (4) | |
| O5 | 0.7677 (10) | 0.3640 (8) | 0.0392 (7) | 0.214 (6) | |
| O6 | 0.9379 (8) | 0.3509 (6) | −0.0429 (5) | 0.149 (4) | |
| S1 | 0.3813 (2) | 0.04741 (18) | 0.32365 (17) | 0.0701 (8) | |
| S2 | 0.8694 (3) | 0.3218 (2) | 0.03687 (17) | 0.0847 (10) | |
| C1 | 0.9898 (7) | 0.3756 (6) | 0.4356 (6) | 0.052 (2) | |
| C2 | 1.0662 (7) | 0.3246 (6) | 0.3096 (7) | 0.065 (3) | |
| C3 | 1.0311 (7) | 0.4084 (7) | 0.2618 (6) | 0.058 (3) | |
| C4 | 1.1296 (8) | 0.2516 (7) | 0.2610 (7) | 0.103 (4) | |
| H4C | 1.1978 | 0.2677 | 0.2361 | 0.154* | |
| H4D | 1.1021 | 0.2468 | 0.2147 | 0.154* | |
| H4E | 1.1289 | 0.1944 | 0.3013 | 0.154* | |
| C5 | 1.0511 (8) | 0.4285 (7) | 0.1647 (6) | 0.084 (3) | |
| H5A | 1.0256 | 0.4900 | 0.1458 | 0.127* | |
| H5B | 1.0181 | 0.3875 | 0.1474 | 0.127* | |
| H5C | 1.1226 | 0.4211 | 0.1379 | 0.127* | |
| C6 | 0.7315 (6) | 0.6171 (6) | 0.6418 (5) | 0.048 (2) | |
| C7 | 0.7255 (7) | 0.5173 (6) | 0.7707 (5) | 0.052 (2) | |
| C8 | 0.7839 (6) | 0.4525 (6) | 0.7222 (5) | 0.049 (2) | |
| C9 | 0.6924 (8) | 0.4960 (6) | 0.8691 (5) | 0.077 (3) | |
| H9A | 0.6467 | 0.5452 | 0.8904 | 0.115* | |
| H9B | 0.7504 | 0.4883 | 0.8913 | 0.115* | |
| H9C | 0.6591 | 0.4410 | 0.8888 | 0.115* | |
| C10 | 0.8154 (7) | 0.3597 (6) | 0.7640 (5) | 0.070 (3) | |
| H10A | 0.8526 | 0.3260 | 0.7192 | 0.105* | |
| H10B | 0.7568 | 0.3296 | 0.7997 | 0.105* | |
| H10C | 0.8575 | 0.3633 | 0.8002 | 0.105* | |
| C11 | 0.8691 (7) | 0.7275 (7) | 0.2671 (6) | 0.059 (3) | |
| C12 | 0.7896 (8) | 0.8702 (7) | 0.2633 (7) | 0.067 (3) | |
| C13 | 0.7515 (8) | 0.8503 (7) | 0.3542 (7) | 0.065 (3) | |
| C14 | 0.7622 (9) | 0.9608 (6) | 0.2120 (7) | 0.098 (4) | |
| H14A | 0.8102 | 0.9711 | 0.1550 | 0.147* | |
| H14B | 0.7627 | 1.0075 | 0.2428 | 0.147* | |
| H14C | 0.6959 | 0.9618 | 0.2051 | 0.147* | |
| C15 | 0.6843 (8) | 0.9157 (6) | 0.4067 (7) | 0.084 (3) | |
| H15A | 0.6615 | 0.8858 | 0.4671 | 0.126* | |
| H15B | 0.6272 | 0.9378 | 0.3839 | 0.126* | |
| H15C | 0.7210 | 0.9659 | 0.4029 | 0.126* | |
| C16 | 0.6146 (7) | 0.7535 (7) | 0.2442 (6) | 0.061 (3) | |
| C17 | 0.7000 (8) | 0.7623 (8) | 0.1020 (6) | 0.074 (3) | |
| C18 | 0.7366 (7) | 0.6708 (7) | 0.1215 (6) | 0.064 (3) | |
| C19 | 0.7335 (10) | 0.8184 (8) | 0.0091 (6) | 0.116 (5) | |
| H19A | 0.7058 | 0.8804 | 0.0090 | 0.175* | |
| H19B | 0.7099 | 0.7942 | −0.0302 | 0.175* | |
| H19C | 0.8059 | 0.8160 | −0.0099 | 0.175* | |
| C20 | 0.8052 (8) | 0.6208 (7) | 0.0535 (6) | 0.096 (4) | |
| H20C | 0.8217 | 0.5595 | 0.0811 | 0.144* | |
| H20D | 0.8659 | 0.6508 | 0.0260 | 0.144* | |
| H20E | 0.7718 | 0.6198 | 0.0098 | 0.144* | |
| C21 | 0.5172 (6) | 0.5868 (6) | 0.6048 (5) | 0.046 (2) | |
| C22 | 0.4371 (6) | 0.7125 (6) | 0.6571 (5) | 0.048 (2) | |
| C23 | 0.4594 (6) | 0.7599 (6) | 0.5694 (5) | 0.050 (2) | |
| C24 | 0.3812 (7) | 0.7587 (6) | 0.7333 (5) | 0.071 (3) | |
| H24C | 0.3665 | 0.7139 | 0.7867 | 0.107* | |
| H24D | 0.3193 | 0.7901 | 0.7232 | 0.107* | |
| H24E | 0.4223 | 0.8014 | 0.7383 | 0.107* | |
| C25 | 0.4255 (7) | 0.8606 (5) | 0.5461 (6) | 0.070 (3) | |
| H25A | 0.4486 | 0.8812 | 0.4836 | 0.105* | |
| H25B | 0.4533 | 0.8945 | 0.5752 | 0.105* | |
| H25C | 0.3531 | 0.8694 | 0.5649 | 0.105* | |
| C26 | 0.7627 (6) | 0.3861 (6) | 0.3496 (5) | 0.049 (2) | |
| C27 | 0.7902 (7) | 0.2612 (6) | 0.4510 (6) | 0.053 (2) | |
| C28 | 0.7321 (7) | 0.3089 (6) | 0.5175 (6) | 0.052 (2) | |
| C29 | 0.8393 (7) | 0.1653 (6) | 0.4724 (6) | 0.076 (3) | |
| H29A | 0.8638 | 0.1403 | 0.4199 | 0.114* | |
| H29B | 0.7905 | 0.1280 | 0.5154 | 0.114* | |
| H29C | 0.8947 | 0.1670 | 0.4956 | 0.114* | |
| C30 | 0.7119 (7) | 0.2661 (6) | 0.6133 (5) | 0.072 (3) | |
| H30A | 0.6754 | 0.3102 | 0.6481 | 0.108* | |
| H30B | 0.7748 | 0.2453 | 0.6273 | 0.108* | |
| H30C | 0.6725 | 0.2156 | 0.6259 | 0.108* | |
| C31 | 0.5450 (8) | 0.5607 (7) | 0.1187 (6) | 0.068 (3) | |
| C32 | 0.5135 (8) | 0.6842 (7) | 0.0203 (6) | 0.075 (3) | |
| C33 | 0.4539 (8) | 0.7238 (7) | 0.0937 (7) | 0.073 (3) | |
| C34 | 0.5243 (10) | 0.7321 (8) | −0.0731 (7) | 0.119 (5) | |
| H34A | 0.5519 | 0.6895 | −0.1116 | 0.179* | |
| H34B | 0.5686 | 0.7793 | −0.0877 | 0.179* | |
| H34C | 0.4592 | 0.7583 | −0.0799 | 0.179* | |
| C35 | 0.4012 (9) | 0.8178 (8) | 0.0817 (7) | 0.112 (4) | |
| H35A | 0.3554 | 0.8211 | 0.0470 | 0.168* | |
| H35B | 0.4503 | 0.8610 | 0.0522 | 0.168* | |
| H35C | 0.3643 | 0.8316 | 0.1382 | 0.168* | |
| C36 | 0.9397 (10) | 0.8981 (8) | 0.4200 (8) | 0.085 (3) | |
| C37 | 0.9790 (10) | 0.9965 (8) | 0.2892 (9) | 0.096 (4) | |
| C38 | 1.0467 (10) | 0.9251 (10) | 0.2541 (9) | 0.097 (4) | |
| C39 | 0.9637 (11) | 1.0926 (8) | 0.2341 (9) | 0.141 (6) | |
| H39A | 0.8928 | 1.1098 | 0.2419 | 0.212* | |
| H39B | 0.9964 | 1.0923 | 0.1730 | 0.212* | |
| H39C | 0.9924 | 1.1353 | 0.2531 | 0.212* | |
| C40 | 1.1061 (11) | 0.9389 (9) | 0.1612 (9) | 0.152 (6) | |
| H40A | 1.1435 | 0.8827 | 0.1485 | 0.228* | |
| H40B | 1.1520 | 0.9841 | 0.1502 | 0.228* | |
| H40C | 1.0614 | 0.9589 | 0.1242 | 0.228* | |
| C41 | 0.3497 (14) | 0.0270 (10) | 0.2315 (10) | 0.119 (5) | |
| C42 | 0.8448 (17) | 0.2119 (12) | 0.0317 (11) | 0.141 (6) |
| Ag1 | 0.0740 (6) | 0.0538 (5) | 0.0445 (4) | 0.0110 (4) | −0.0075 (4) | −0.0140 (3) |
| Ag2 | 0.0749 (6) | 0.0506 (4) | 0.0435 (4) | 0.0070 (4) | −0.0073 (4) | −0.0135 (3) |
| F1 | 0.252 (11) | 0.104 (6) | 0.166 (8) | −0.009 (7) | −0.089 (7) | −0.056 (5) |
| F2 | 0.249 (12) | 0.172 (9) | 0.200 (9) | 0.077 (8) | −0.161 (10) | −0.068 (7) |
| F3 | 0.287 (14) | 0.167 (8) | 0.085 (6) | 0.017 (9) | −0.001 (7) | −0.027 (5) |
| F4 | 0.245 (13) | 0.124 (7) | 0.176 (9) | −0.063 (8) | 0.002 (9) | 0.019 (6) |
| F5 | 0.319 (16) | 0.196 (10) | 0.153 (9) | −0.064 (10) | −0.087 (10) | −0.047 (7) |
| F6 | 0.284 (15) | 0.157 (9) | 0.183 (10) | 0.088 (10) | −0.005 (10) | −0.017 (7) |
| N1 | 0.052 (5) | 0.061 (5) | 0.054 (5) | −0.003 (4) | −0.008 (4) | −0.020 (4) |
| N2 | 0.048 (5) | 0.060 (5) | 0.052 (5) | 0.002 (4) | −0.010 (4) | −0.027 (4) |
| N3 | 0.052 (5) | 0.059 (5) | 0.068 (5) | 0.007 (4) | −0.015 (4) | −0.033 (4) |
| N4 | 0.067 (6) | 0.047 (4) | 0.054 (5) | 0.018 (4) | −0.014 (4) | −0.014 (3) |
| N5 | 0.045 (5) | 0.049 (4) | 0.046 (4) | −0.001 (4) | −0.006 (3) | −0.010 (3) |
| N6 | 0.058 (5) | 0.044 (4) | 0.040 (4) | 0.002 (4) | −0.003 (4) | −0.017 (3) |
| N7 | 0.049 (5) | 0.060 (5) | 0.042 (4) | −0.005 (4) | −0.003 (4) | −0.018 (4) |
| N8 | 0.057 (5) | 0.056 (5) | 0.049 (4) | 0.010 (4) | −0.007 (4) | −0.018 (4) |
| N9 | 0.066 (6) | 0.056 (5) | 0.066 (5) | 0.005 (4) | −0.019 (4) | −0.019 (4) |
| N10 | 0.055 (5) | 0.051 (5) | 0.055 (5) | −0.002 (4) | −0.019 (4) | −0.006 (4) |
| N11 | 0.063 (6) | 0.069 (6) | 0.063 (5) | −0.008 (5) | −0.024 (4) | 0.004 (5) |
| N12 | 0.067 (6) | 0.077 (6) | 0.050 (5) | −0.001 (5) | 0.002 (4) | −0.010 (4) |
| N13 | 0.067 (6) | 0.074 (5) | 0.041 (4) | −0.002 (4) | −0.012 (4) | −0.017 (4) |
| N14 | 0.060 (5) | 0.060 (5) | 0.044 (4) | −0.006 (4) | −0.017 (4) | −0.013 (4) |
| N15 | 0.082 (7) | 0.071 (5) | 0.048 (5) | −0.009 (5) | −0.020 (5) | 0.002 (4) |
| N16 | 0.083 (6) | 0.057 (5) | 0.056 (5) | 0.010 (5) | −0.021 (4) | −0.009 (4) |
| N17 | 0.056 (5) | 0.048 (5) | 0.052 (4) | 0.006 (4) | −0.013 (4) | −0.016 (4) |
| N18 | 0.046 (5) | 0.049 (4) | 0.036 (4) | 0.006 (4) | −0.006 (3) | −0.018 (3) |
| N19 | 0.046 (5) | 0.051 (4) | 0.042 (4) | 0.000 (4) | −0.009 (3) | −0.017 (3) |
| N20 | 0.056 (5) | 0.050 (5) | 0.039 (4) | 0.003 (4) | −0.001 (3) | −0.012 (3) |
| N21 | 0.045 (5) | 0.051 (5) | 0.048 (4) | 0.010 (4) | −0.016 (4) | −0.016 (4) |
| N22 | 0.046 (5) | 0.048 (4) | 0.053 (4) | 0.003 (4) | −0.010 (4) | −0.018 (4) |
| N23 | 0.050 (5) | 0.052 (5) | 0.065 (5) | 0.006 (4) | −0.016 (4) | −0.027 (4) |
| N24 | 0.066 (6) | 0.068 (5) | 0.046 (4) | 0.009 (4) | −0.007 (4) | −0.023 (4) |
| N25 | 0.077 (6) | 0.077 (6) | 0.058 (5) | 0.000 (5) | −0.012 (5) | −0.030 (5) |
| N26 | 0.068 (6) | 0.075 (6) | 0.049 (5) | 0.004 (5) | −0.014 (4) | −0.023 (4) |
| N27 | 0.084 (7) | 0.076 (6) | 0.048 (5) | 0.009 (5) | −0.008 (4) | −0.011 (4) |
| N28 | 0.113 (8) | 0.075 (6) | 0.053 (5) | 0.023 (6) | −0.011 (5) | −0.019 (4) |
| N29 | 0.089 (8) | 0.090 (8) | 0.101 (8) | 0.015 (6) | −0.028 (7) | −0.025 (6) |
| N30 | 0.083 (7) | 0.071 (6) | 0.098 (7) | 0.014 (6) | −0.027 (6) | −0.015 (6) |
| N31 | 0.102 (8) | 0.071 (6) | 0.098 (7) | 0.007 (6) | −0.033 (7) | −0.010 (6) |
| N32 | 0.098 (8) | 0.084 (7) | 0.099 (7) | 0.028 (6) | −0.021 (6) | −0.017 (6) |
| O1 | 0.150 (8) | 0.069 (5) | 0.138 (7) | 0.010 (5) | −0.045 (6) | −0.048 (5) |
| O2 | 0.143 (8) | 0.122 (7) | 0.111 (7) | −0.015 (6) | 0.033 (6) | −0.033 (5) |
| O3 | 0.135 (8) | 0.108 (6) | 0.152 (8) | 0.066 (6) | −0.067 (6) | −0.053 (5) |
| O4 | 0.227 (12) | 0.205 (11) | 0.095 (7) | −0.073 (9) | −0.031 (7) | −0.049 (7) |
| O5 | 0.198 (13) | 0.191 (11) | 0.171 (10) | 0.092 (10) | −0.010 (9) | 0.000 (8) |
| O6 | 0.182 (10) | 0.146 (8) | 0.084 (6) | −0.048 (7) | 0.026 (6) | −0.017 (5) |
| S1 | 0.087 (2) | 0.0575 (17) | 0.0635 (16) | 0.0187 (16) | −0.0222 (15) | −0.0228 (13) |
| S2 | 0.122 (3) | 0.0719 (19) | 0.0451 (15) | −0.0117 (19) | 0.0017 (17) | −0.0132 (13) |
| C1 | 0.048 (6) | 0.055 (6) | 0.058 (6) | 0.001 (5) | −0.015 (5) | −0.021 (5) |
| C2 | 0.056 (7) | 0.061 (7) | 0.082 (7) | 0.005 (5) | −0.010 (6) | −0.042 (6) |
| C3 | 0.053 (7) | 0.073 (7) | 0.057 (6) | −0.006 (5) | −0.011 (5) | −0.036 (5) |
| C4 | 0.109 (10) | 0.091 (8) | 0.107 (9) | 0.016 (7) | −0.010 (7) | −0.062 (7) |
| C5 | 0.089 (9) | 0.103 (8) | 0.058 (6) | −0.008 (7) | 0.000 (6) | −0.036 (6) |
| C6 | 0.044 (6) | 0.054 (6) | 0.047 (5) | 0.000 (5) | −0.010 (4) | −0.017 (4) |
| C7 | 0.056 (6) | 0.056 (6) | 0.043 (5) | −0.003 (5) | −0.009 (4) | −0.013 (4) |
| C8 | 0.049 (6) | 0.055 (6) | 0.040 (5) | 0.005 (5) | −0.011 (4) | −0.014 (4) |
| C9 | 0.090 (8) | 0.088 (7) | 0.049 (6) | −0.009 (6) | −0.007 (5) | −0.021 (5) |
| C10 | 0.067 (7) | 0.075 (7) | 0.054 (6) | 0.007 (6) | −0.006 (5) | −0.004 (5) |
| C11 | 0.063 (7) | 0.063 (7) | 0.054 (6) | −0.005 (6) | −0.024 (5) | −0.011 (5) |
| C12 | 0.070 (8) | 0.057 (7) | 0.075 (7) | −0.013 (6) | −0.031 (6) | 0.007 (6) |
| C13 | 0.068 (8) | 0.057 (6) | 0.075 (7) | 0.006 (6) | −0.033 (6) | −0.011 (5) |
| C14 | 0.112 (10) | 0.067 (7) | 0.107 (9) | −0.007 (7) | −0.043 (8) | 0.017 (6) |
| C15 | 0.085 (8) | 0.060 (7) | 0.105 (8) | 0.030 (6) | −0.036 (7) | −0.023 (6) |
| C16 | 0.067 (7) | 0.071 (7) | 0.047 (6) | −0.003 (6) | −0.024 (5) | −0.004 (5) |
| C17 | 0.079 (8) | 0.091 (8) | 0.050 (6) | −0.013 (7) | −0.020 (6) | −0.002 (6) |
| C18 | 0.065 (7) | 0.077 (7) | 0.045 (6) | −0.002 (6) | −0.009 (5) | −0.016 (5) |
| C19 | 0.139 (12) | 0.121 (10) | 0.070 (8) | −0.018 (9) | −0.022 (8) | 0.016 (7) |
| C20 | 0.103 (10) | 0.117 (9) | 0.057 (6) | −0.010 (8) | −0.002 (6) | −0.020 (6) |
| C21 | 0.045 (6) | 0.054 (6) | 0.039 (5) | −0.005 (5) | −0.007 (4) | −0.019 (4) |
| C22 | 0.043 (6) | 0.057 (6) | 0.049 (5) | 0.004 (5) | −0.010 (4) | −0.028 (4) |
| C23 | 0.044 (6) | 0.054 (6) | 0.052 (5) | 0.008 (5) | −0.013 (4) | −0.019 (5) |
| C24 | 0.077 (8) | 0.070 (6) | 0.059 (6) | 0.011 (6) | −0.006 (5) | −0.025 (5) |
| C25 | 0.079 (8) | 0.056 (6) | 0.064 (6) | 0.017 (6) | −0.012 (5) | −0.016 (5) |
| C26 | 0.044 (6) | 0.052 (6) | 0.053 (6) | 0.000 (5) | −0.009 (4) | −0.024 (5) |
| C27 | 0.056 (6) | 0.045 (5) | 0.063 (6) | 0.001 (5) | −0.021 (5) | −0.018 (5) |
| C28 | 0.048 (6) | 0.051 (6) | 0.060 (6) | 0.003 (5) | −0.019 (5) | −0.019 (5) |
| C29 | 0.079 (8) | 0.059 (6) | 0.089 (7) | 0.007 (6) | −0.019 (6) | −0.025 (5) |
| C30 | 0.074 (8) | 0.068 (6) | 0.062 (6) | 0.015 (6) | −0.014 (5) | −0.011 (5) |
| C31 | 0.084 (8) | 0.071 (7) | 0.044 (6) | 0.001 (6) | −0.011 (5) | −0.019 (5) |
| C32 | 0.088 (9) | 0.074 (7) | 0.057 (6) | 0.001 (7) | −0.015 (6) | −0.015 (6) |
| C33 | 0.080 (8) | 0.079 (8) | 0.062 (7) | 0.002 (6) | −0.020 (6) | −0.026 (6) |
| C34 | 0.143 (12) | 0.108 (10) | 0.078 (8) | 0.024 (9) | −0.016 (8) | −0.005 (7) |
| C35 | 0.127 (12) | 0.095 (9) | 0.108 (9) | 0.030 (8) | −0.026 (8) | −0.041 (7) |
| C36 | 0.090 (10) | 0.070 (8) | 0.097 (9) | 0.003 (7) | −0.037 (8) | −0.015 (7) |
| C37 | 0.099 (10) | 0.086 (9) | 0.095 (9) | −0.001 (8) | −0.027 (8) | −0.004 (8) |
| C38 | 0.097 (11) | 0.089 (10) | 0.100 (10) | 0.000 (8) | −0.022 (8) | −0.017 (8) |
| C39 | 0.163 (15) | 0.092 (10) | 0.153 (13) | −0.020 (10) | −0.052 (11) | 0.024 (9) |
| C40 | 0.160 (15) | 0.137 (13) | 0.125 (12) | 0.007 (11) | −0.007 (11) | −0.013 (10) |
| C41 | 0.159 (16) | 0.081 (10) | 0.124 (12) | 0.036 (11) | −0.060 (12) | −0.036 (9) |
| C42 | 0.20 (2) | 0.149 (16) | 0.074 (10) | −0.023 (15) | −0.034 (12) | −0.021 (10) |
| Ag1—N10 | 2.241 (6) | O3—S1 | 1.427 (8) |
| Ag1—N6 | 2.248 (6) | O4—S2 | 1.316 (9) |
| Ag1—N2 | 2.287 (7) | O5—S2 | 1.457 (12) |
| Ag2—N14 | 2.251 (7) | O6—S2 | 1.380 (8) |
| Ag2—N18 | 2.264 (6) | S1—C41 | 1.781 (14) |
| Ag2—N22 | 2.273 (6) | S2—C42 | 1.777 (18) |
| F1—C41 | 1.290 (14) | C2—C3 | 1.430 (12) |
| F2—C41 | 1.234 (14) | C2—C4 | 1.520 (12) |
| F3—C41 | 1.345 (17) | C3—C5 | 1.482 (11) |
| F4—C42 | 1.217 (16) | C4—H4C | 0.9600 |
| F5—C42 | 1.260 (15) | C4—H4D | 0.9600 |
| F6—C42 | 1.36 (2) | C4—H4E | 0.9600 |
| N1—C3 | 1.301 (10) | C5—H5A | 0.9600 |
| N1—N2 | 1.334 (8) | C5—H5B | 0.9600 |
| N2—C1 | 1.342 (10) | C5—H5C | 0.9600 |
| N3—C2 | 1.300 (11) | C7—C8 | 1.405 (11) |
| N3—C1 | 1.348 (10) | C7—C9 | 1.494 (11) |
| N4—C1 | 1.336 (9) | C8—C10 | 1.479 (11) |
| N4—H4A | 0.8600 | C9—H9A | 0.9600 |
| N4—H4B | 0.8600 | C9—H9B | 0.9600 |
| N5—C8 | 1.311 (9) | C9—H9C | 0.9600 |
| N5—N6 | 1.355 (8) | C10—H10A | 0.9600 |
| N6—C6 | 1.336 (9) | C10—H10B | 0.9600 |
| N7—C7 | 1.315 (10) | C10—H10C | 0.9600 |
| N7—C6 | 1.357 (9) | C12—C13 | 1.388 (12) |
| N8—C6 | 1.333 (9) | C12—C14 | 1.493 (12) |
| N8—H8A | 0.8600 | C13—C15 | 1.488 (12) |
| N8—H8B | 0.8600 | C14—H14A | 0.9600 |
| N9—C13 | 1.329 (10) | C14—H14B | 0.9600 |
| N9—N10 | 1.362 (9) | C14—H14C | 0.9600 |
| N10—C11 | 1.350 (10) | C15—H15A | 0.9600 |
| N11—C12 | 1.302 (12) | C15—H15B | 0.9600 |
| N11—C11 | 1.349 (11) | C15—H15C | 0.9600 |
| N12—C11 | 1.301 (10) | C17—C18 | 1.402 (13) |
| N12—H12A | 0.8600 | C17—C19 | 1.524 (12) |
| N12—H12B | 0.8600 | C18—C20 | 1.496 (12) |
| N13—C18 | 1.301 (10) | C19—H19A | 0.9600 |
| N13—N14 | 1.338 (9) | C19—H19B | 0.9600 |
| N14—C16 | 1.341 (10) | C19—H19C | 0.9600 |
| N15—C17 | 1.309 (12) | C20—H20C | 0.9600 |
| N15—C16 | 1.338 (10) | C20—H20D | 0.9600 |
| N16—C16 | 1.342 (11) | C20—H20E | 0.9600 |
| N16—H16A | 0.8600 | C22—C23 | 1.405 (11) |
| N16—H16B | 0.8600 | C22—C24 | 1.509 (10) |
| N17—C23 | 1.288 (9) | C23—C25 | 1.522 (11) |
| N17—N18 | 1.339 (8) | C24—H24C | 0.9600 |
| N18—C21 | 1.325 (9) | C24—H24D | 0.9600 |
| N19—C22 | 1.315 (9) | C24—H24E | 0.9600 |
| N19—C21 | 1.354 (9) | C25—H25A | 0.9600 |
| N20—C21 | 1.340 (9) | C25—H25B | 0.9600 |
| N20—H20A | 0.8600 | C25—H25C | 0.9600 |
| N20—H20B | 0.8600 | C27—C28 | 1.414 (11) |
| N21—C28 | 1.287 (9) | C27—C29 | 1.521 (11) |
| N21—N22 | 1.346 (8) | C28—C30 | 1.499 (11) |
| N22—C26 | 1.356 (9) | C29—H29A | 0.9600 |
| N23—C27 | 1.314 (10) | C29—H29B | 0.9600 |
| N23—C26 | 1.354 (10) | C29—H29C | 0.9600 |
| N24—C26 | 1.335 (9) | C30—H30A | 0.9600 |
| N24—H24A | 0.8600 | C30—H30B | 0.9600 |
| N24—H24B | 0.8600 | C30—H30C | 0.9600 |
| N25—C33 | 1.298 (11) | C32—C33 | 1.433 (13) |
| N25—N26 | 1.335 (9) | C32—C34 | 1.496 (13) |
| N26—C31 | 1.311 (10) | C33—C35 | 1.500 (13) |
| N27—C32 | 1.287 (11) | C34—H34A | 0.9600 |
| N27—C31 | 1.364 (10) | C34—H34B | 0.9600 |
| N28—C31 | 1.338 (11) | C34—H34C | 0.9600 |
| N28—H28A | 0.8600 | C35—H35A | 0.9600 |
| N28—H28B | 0.8600 | C35—H35B | 0.9600 |
| N29—N30 | 1.304 (11) | C35—H35C | 0.9600 |
| N29—C38 | 1.316 (13) | C37—C38 | 1.427 (15) |
| N30—C36 | 1.355 (13) | C37—C39 | 1.546 (14) |
| N31—C37 | 1.311 (13) | C38—C40 | 1.470 (15) |
| N31—C36 | 1.354 (12) | C39—H39A | 0.9600 |
| N32—C36 | 1.347 (12) | C39—H39B | 0.9600 |
| N32—H32A | 0.8600 | C39—H39C | 0.9600 |
| N32—H32B | 0.8600 | C40—H40A | 0.9600 |
| O1—S1 | 1.415 (7) | C40—H40B | 0.9600 |
| O2—S1 | 1.405 (8) | C40—H40C | 0.9600 |
| N10—Ag1—N6 | 121.8 (3) | C12—C14—H14A | 109.5 |
| N10—Ag1—N2 | 119.6 (3) | C12—C14—H14B | 109.5 |
| N6—Ag1—N2 | 118.6 (2) | H14A—C14—H14B | 109.5 |
| N14—Ag2—N18 | 119.9 (3) | C12—C14—H14C | 109.5 |
| N14—Ag2—N22 | 119.5 (3) | H14A—C14—H14C | 109.5 |
| N18—Ag2—N22 | 120.0 (2) | H14B—C14—H14C | 109.5 |
| C3—N1—N2 | 120.7 (8) | C13—C15—H15A | 109.5 |
| N1—N2—C1 | 118.8 (7) | C13—C15—H15B | 109.5 |
| N1—N2—Ag1 | 111.7 (5) | H15A—C15—H15B | 109.5 |
| C1—N2—Ag1 | 129.4 (6) | C13—C15—H15C | 109.5 |
| C2—N3—C1 | 116.8 (8) | H15A—C15—H15C | 109.5 |
| C1—N4—H4A | 120.0 | H15B—C15—H15C | 109.5 |
| C1—N4—H4B | 120.0 | N15—C16—N14 | 124.5 (9) |
| H4A—N4—H4B | 120.0 | N15—C16—N16 | 116.7 (9) |
| C8—N5—N6 | 119.7 (7) | N14—C16—N16 | 118.8 (8) |
| C6—N6—N5 | 118.5 (7) | N15—C17—C18 | 121.7 (9) |
| C6—N6—Ag1 | 129.8 (6) | N15—C17—C19 | 117.4 (10) |
| N5—N6—Ag1 | 111.4 (5) | C18—C17—C19 | 120.9 (10) |
| C7—N7—C6 | 116.4 (7) | N13—C18—C17 | 119.8 (9) |
| C6—N8—H8A | 120.0 | N13—C18—C20 | 117.0 (9) |
| C6—N8—H8B | 120.0 | C17—C18—C20 | 123.2 (9) |
| H8A—N8—H8B | 120.0 | C17—C19—H19A | 109.5 |
| C13—N9—N10 | 118.3 (8) | C17—C19—H19B | 109.5 |
| C11—N10—N9 | 119.4 (7) | H19A—C19—H19B | 109.5 |
| C11—N10—Ag1 | 129.3 (6) | C17—C19—H19C | 109.5 |
| N9—N10—Ag1 | 111.2 (5) | H19A—C19—H19C | 109.5 |
| C12—N11—C11 | 118.0 (9) | H19B—C19—H19C | 109.5 |
| C11—N12—H12A | 120.0 | C18—C20—H20C | 109.5 |
| C11—N12—H12B | 120.0 | C18—C20—H20D | 109.5 |
| H12A—N12—H12B | 120.0 | H20C—C20—H20D | 109.5 |
| C18—N13—N14 | 119.8 (8) | C18—C20—H20E | 109.5 |
| N13—N14—C16 | 118.5 (7) | H20C—C20—H20E | 109.5 |
| N13—N14—Ag2 | 112.2 (5) | H20D—C20—H20E | 109.5 |
| C16—N14—Ag2 | 129.3 (6) | N18—C21—N20 | 119.3 (7) |
| C17—N15—C16 | 115.6 (9) | N18—C21—N19 | 124.7 (8) |
| C16—N16—H16A | 120.0 | N20—C21—N19 | 116.0 (7) |
| C16—N16—H16B | 120.0 | N19—C22—C23 | 119.9 (7) |
| H16A—N16—H16B | 120.0 | N19—C22—C24 | 117.9 (7) |
| C23—N17—N18 | 120.2 (7) | C23—C22—C24 | 122.1 (8) |
| C21—N18—N17 | 118.0 (6) | N17—C23—C22 | 121.1 (8) |
| C21—N18—Ag2 | 128.0 (5) | N17—C23—C25 | 117.5 (7) |
| N17—N18—Ag2 | 113.9 (5) | C22—C23—C25 | 121.4 (7) |
| C22—N19—C21 | 116.0 (7) | C22—C24—H24C | 109.5 |
| C21—N20—H20A | 120.0 | C22—C24—H24D | 109.5 |
| C21—N20—H20B | 120.0 | H24C—C24—H24D | 109.5 |
| H20A—N20—H20B | 120.0 | C22—C24—H24E | 109.5 |
| C28—N21—N22 | 120.7 (7) | H24C—C24—H24E | 109.5 |
| N21—N22—C26 | 118.0 (7) | H24D—C24—H24E | 109.5 |
| N21—N22—Ag2 | 112.0 (5) | C23—C25—H25A | 109.5 |
| C26—N22—Ag2 | 130.0 (6) | C23—C25—H25B | 109.5 |
| C27—N23—C26 | 116.9 (7) | H25A—C25—H25B | 109.5 |
| C26—N24—H24A | 120.0 | C23—C25—H25C | 109.5 |
| C26—N24—H24B | 120.0 | H25A—C25—H25C | 109.5 |
| H24A—N24—H24B | 120.0 | H25B—C25—H25C | 109.5 |
| C33—N25—N26 | 119.9 (8) | N24—C26—N23 | 118.2 (7) |
| C31—N26—N25 | 118.4 (8) | N24—C26—N22 | 118.3 (8) |
| C32—N27—C31 | 115.9 (8) | N23—C26—N22 | 123.5 (8) |
| C31—N28—H28A | 120.0 | N23—C27—C28 | 120.3 (8) |
| C31—N28—H28B | 120.0 | N23—C27—C29 | 117.7 (8) |
| H28A—N28—H28B | 120.0 | C28—C27—C29 | 122.0 (8) |
| N30—N29—C38 | 120.9 (11) | N21—C28—C27 | 120.7 (8) |
| N29—N30—C36 | 118.5 (9) | N21—C28—C30 | 117.5 (8) |
| C37—N31—C36 | 116.4 (11) | C27—C28—C30 | 121.8 (8) |
| C36—N32—H32A | 120.0 | C27—C29—H29A | 109.5 |
| C36—N32—H32B | 120.0 | C27—C29—H29B | 109.5 |
| H32A—N32—H32B | 120.0 | H29A—C29—H29B | 109.5 |
| O2—S1—O1 | 113.3 (5) | C27—C29—H29C | 109.5 |
| O2—S1—O3 | 115.2 (5) | H29A—C29—H29C | 109.5 |
| O1—S1—O3 | 116.6 (6) | H29B—C29—H29C | 109.5 |
| O2—S1—C41 | 101.2 (8) | C28—C30—H30A | 109.5 |
| O1—S1—C41 | 105.7 (6) | C28—C30—H30B | 109.5 |
| O3—S1—C41 | 102.3 (6) | H30A—C30—H30B | 109.5 |
| O4—S2—O6 | 126.8 (7) | C28—C30—H30C | 109.5 |
| O4—S2—O5 | 105.8 (7) | H30A—C30—H30C | 109.5 |
| O6—S2—O5 | 111.8 (6) | H30B—C30—H30C | 109.5 |
| O4—S2—C42 | 107.6 (7) | N26—C31—N28 | 118.5 (9) |
| O6—S2—C42 | 104.8 (7) | N26—C31—N27 | 125.3 (10) |
| O5—S2—C42 | 95.6 (10) | N28—C31—N27 | 116.1 (9) |
| N4—C1—N2 | 119.2 (8) | N27—C32—C33 | 120.3 (9) |
| N4—C1—N3 | 117.2 (8) | N27—C32—C34 | 117.3 (9) |
| N2—C1—N3 | 123.5 (8) | C33—C32—C34 | 122.5 (10) |
| N3—C2—C3 | 121.1 (8) | N25—C33—C32 | 120.1 (10) |
| N3—C2—C4 | 118.6 (9) | N25—C33—C35 | 117.9 (9) |
| C3—C2—C4 | 120.3 (9) | C32—C33—C35 | 121.9 (10) |
| N1—C3—C2 | 118.9 (8) | C32—C34—H34A | 109.5 |
| N1—C3—C5 | 118.0 (9) | C32—C34—H34B | 109.5 |
| C2—C3—C5 | 123.1 (9) | H34A—C34—H34B | 109.5 |
| C2—C4—H4C | 109.5 | C32—C34—H34C | 109.5 |
| C2—C4—H4D | 109.5 | H34A—C34—H34C | 109.5 |
| H4C—C4—H4D | 109.5 | H34B—C34—H34C | 109.5 |
| C2—C4—H4E | 109.5 | C33—C35—H35A | 109.5 |
| H4C—C4—H4E | 109.5 | C33—C35—H35B | 109.5 |
| H4D—C4—H4E | 109.5 | H35A—C35—H35B | 109.5 |
| C3—C5—H5A | 109.5 | C33—C35—H35C | 109.5 |
| C3—C5—H5B | 109.5 | H35A—C35—H35C | 109.5 |
| H5A—C5—H5B | 109.5 | H35B—C35—H35C | 109.5 |
| C3—C5—H5C | 109.5 | N32—C36—N31 | 117.3 (12) |
| H5A—C5—H5C | 109.5 | N32—C36—N30 | 118.5 (11) |
| H5B—C5—H5C | 109.5 | N31—C36—N30 | 124.1 (12) |
| N8—C6—N6 | 118.8 (7) | N31—C37—C38 | 120.1 (11) |
| N8—C6—N7 | 117.1 (8) | N31—C37—C39 | 116.7 (12) |
| N6—C6—N7 | 124.0 (8) | C38—C37—C39 | 123.2 (13) |
| N7—C7—C8 | 121.0 (7) | N29—C38—C37 | 119.8 (12) |
| N7—C7—C9 | 117.7 (8) | N29—C38—C40 | 119.0 (13) |
| C8—C7—C9 | 121.2 (8) | C37—C38—C40 | 121.2 (12) |
| N5—C8—C7 | 120.2 (8) | C37—C39—H39A | 109.5 |
| N5—C8—C10 | 116.9 (7) | C37—C39—H39B | 109.5 |
| C7—C8—C10 | 122.9 (7) | H39A—C39—H39B | 109.5 |
| C7—C9—H9A | 109.5 | C37—C39—H39C | 109.5 |
| C7—C9—H9B | 109.5 | H39A—C39—H39C | 109.5 |
| H9A—C9—H9B | 109.5 | H39B—C39—H39C | 109.5 |
| C7—C9—H9C | 109.5 | C38—C40—H40A | 109.5 |
| H9A—C9—H9C | 109.5 | C38—C40—H40B | 109.5 |
| H9B—C9—H9C | 109.5 | H40A—C40—H40B | 109.5 |
| C8—C10—H10A | 109.5 | C38—C40—H40C | 109.5 |
| C8—C10—H10B | 109.5 | H40A—C40—H40C | 109.5 |
| H10A—C10—H10B | 109.5 | H40B—C40—H40C | 109.5 |
| C8—C10—H10C | 109.5 | F2—C41—F1 | 113.1 (16) |
| H10A—C10—H10C | 109.5 | F2—C41—F3 | 102.6 (13) |
| H10B—C10—H10C | 109.5 | F1—C41—F3 | 105.4 (13) |
| N12—C11—N11 | 119.3 (9) | F2—C41—S1 | 114.6 (11) |
| N12—C11—N10 | 118.3 (9) | F1—C41—S1 | 111.9 (10) |
| N11—C11—N10 | 122.4 (9) | F3—C41—S1 | 108.2 (13) |
| N11—C12—C13 | 121.1 (9) | F4—C42—F5 | 120 (2) |
| N11—C12—C14 | 118.4 (10) | F4—C42—F6 | 103.2 (16) |
| C13—C12—C14 | 120.4 (10) | F5—C42—F6 | 101.8 (16) |
| N9—C13—C12 | 120.8 (9) | F4—C42—S2 | 114.5 (12) |
| N9—C13—C15 | 115.6 (9) | F5—C42—S2 | 110.1 (13) |
| C12—C13—C15 | 123.6 (9) | F6—C42—S2 | 105.1 (15) |
| C3—N1—N2—C1 | 2.2 (12) | N13—N14—C16—N15 | −2.2 (13) |
| C3—N1—N2—Ag1 | −174.4 (6) | Ag2—N14—C16—N15 | 176.5 (6) |
| N10—Ag1—N2—N1 | −8.4 (6) | N13—N14—C16—N16 | 179.0 (8) |
| N6—Ag1—N2—N1 | 169.6 (5) | Ag2—N14—C16—N16 | −2.3 (13) |
| N10—Ag1—N2—C1 | 175.5 (7) | C16—N15—C17—C18 | 2.3 (15) |
| N6—Ag1—N2—C1 | −6.6 (8) | C16—N15—C17—C19 | −176.3 (9) |
| C8—N5—N6—C6 | 0.8 (11) | N14—N13—C18—C17 | −0.6 (14) |
| C8—N5—N6—Ag1 | 175.4 (6) | N14—N13—C18—C20 | 179.5 (8) |
| N10—Ag1—N6—C6 | −7.1 (8) | N15—C17—C18—N13 | −2.0 (16) |
| N2—Ag1—N6—C6 | 175.0 (7) | C19—C17—C18—N13 | 176.6 (10) |
| N10—Ag1—N6—N5 | 179.1 (5) | N15—C17—C18—C20 | 178.0 (10) |
| N2—Ag1—N6—N5 | 1.2 (6) | C19—C17—C18—C20 | −3.5 (16) |
| C13—N9—N10—C11 | 0.2 (12) | N17—N18—C21—N20 | 178.0 (7) |
| C13—N9—N10—Ag1 | 176.0 (6) | Ag2—N18—C21—N20 | −2.7 (11) |
| N6—Ag1—N10—C11 | 178.0 (7) | N17—N18—C21—N19 | −1.0 (12) |
| N2—Ag1—N10—C11 | −4.2 (8) | Ag2—N18—C21—N19 | 178.4 (6) |
| N6—Ag1—N10—N9 | 2.6 (6) | C22—N19—C21—N18 | 0.4 (12) |
| N2—Ag1—N10—N9 | −179.5 (5) | C22—N19—C21—N20 | −178.6 (7) |
| C18—N13—N14—C16 | 2.6 (12) | C21—N19—C22—C23 | −0.2 (12) |
| C18—N13—N14—Ag2 | −176.4 (7) | C21—N19—C22—C24 | −179.3 (7) |
| N18—Ag2—N14—N13 | 174.4 (5) | N18—N17—C23—C22 | −1.2 (13) |
| N22—Ag2—N14—N13 | 2.9 (6) | N18—N17—C23—C25 | −179.7 (7) |
| N18—Ag2—N14—C16 | −4.5 (8) | N19—C22—C23—N17 | 0.6 (13) |
| N22—Ag2—N14—C16 | −176.0 (7) | C24—C22—C23—N17 | 179.7 (8) |
| C23—N17—N18—C21 | 1.3 (11) | N19—C22—C23—C25 | 179.1 (8) |
| C23—N17—N18—Ag2 | −178.1 (6) | C24—C22—C23—C25 | −1.8 (13) |
| N14—Ag2—N18—C21 | 179.4 (6) | C27—N23—C26—N24 | −178.6 (8) |
| N22—Ag2—N18—C21 | −9.2 (8) | C27—N23—C26—N22 | −0.1 (12) |
| N14—Ag2—N18—N17 | −1.2 (6) | N21—N22—C26—N24 | 178.3 (7) |
| N22—Ag2—N18—N17 | 170.2 (5) | Ag2—N22—C26—N24 | 1.3 (12) |
| C28—N21—N22—C26 | −0.5 (11) | N21—N22—C26—N23 | −0.3 (12) |
| C28—N21—N22—Ag2 | 177.0 (6) | Ag2—N22—C26—N23 | −177.3 (6) |
| N14—Ag2—N22—N21 | 172.9 (5) | C26—N23—C27—C28 | 1.1 (12) |
| N18—Ag2—N22—N21 | 1.4 (6) | C26—N23—C27—C29 | −178.0 (8) |
| N14—Ag2—N22—C26 | −9.9 (8) | N22—N21—C28—C27 | 1.7 (12) |
| N18—Ag2—N22—C26 | 178.6 (7) | N22—N21—C28—C30 | −178.6 (7) |
| C33—N25—N26—C31 | −0.9 (13) | N23—C27—C28—N21 | −2.0 (13) |
| C38—N29—N30—C36 | 0.5 (17) | C29—C27—C28—N21 | 177.1 (8) |
| N1—N2—C1—N4 | 179.0 (7) | N23—C27—C28—C30 | 178.2 (8) |
| Ag1—N2—C1—N4 | −5.1 (12) | C29—C27—C28—C30 | −2.6 (13) |
| N1—N2—C1—N3 | 1.1 (12) | N25—N26—C31—N28 | 178.6 (8) |
| Ag1—N2—C1—N3 | 177.0 (6) | N25—N26—C31—N27 | −1.1 (15) |
| C2—N3—C1—N4 | −179.9 (8) | C32—N27—C31—N26 | 0.2 (16) |
| C2—N3—C1—N2 | −1.9 (13) | C32—N27—C31—N28 | −179.5 (9) |
| C1—N3—C2—C3 | −0.2 (13) | C31—N27—C32—C33 | 2.5 (15) |
| C1—N3—C2—C4 | 179.5 (8) | C31—N27—C32—C34 | −177.2 (10) |
| N2—N1—C3—C2 | −4.2 (13) | N26—N25—C33—C32 | 3.5 (15) |
| N2—N1—C3—C5 | 177.7 (8) | N26—N25—C33—C35 | −179.0 (9) |
| N3—C2—C3—N1 | 3.3 (14) | N27—C32—C33—N25 | −4.5 (16) |
| C4—C2—C3—N1 | −176.4 (9) | C34—C32—C33—N25 | 175.2 (10) |
| N3—C2—C3—C5 | −178.7 (9) | N27—C32—C33—C35 | 178.1 (10) |
| C4—C2—C3—C5 | 1.6 (14) | C34—C32—C33—C35 | −2.2 (17) |
| N5—N6—C6—N8 | 177.8 (7) | C37—N31—C36—N32 | 178.3 (11) |
| Ag1—N6—C6—N8 | 4.4 (12) | C37—N31—C36—N30 | −4.8 (17) |
| N5—N6—C6—N7 | 0.6 (12) | N29—N30—C36—N32 | 179.7 (10) |
| Ag1—N6—C6—N7 | −172.8 (6) | N29—N30—C36—N31 | 2.9 (17) |
| C7—N7—C6—N8 | −179.7 (7) | C36—N31—C37—C38 | 3.4 (18) |
| C7—N7—C6—N6 | −2.4 (12) | C36—N31—C37—C39 | −178.3 (10) |
| C6—N7—C7—C8 | 2.8 (12) | N30—N29—C38—C37 | −1.7 (19) |
| C6—N7—C7—C9 | −179.7 (8) | N30—N29—C38—C40 | −179.5 (12) |
| N6—N5—C8—C7 | −0.4 (12) | N31—C37—C38—N29 | 0(2) |
| N6—N5—C8—C10 | 179.8 (7) | C39—C37—C38—N29 | −178.6 (12) |
| N7—C7—C8—N5 | −1.5 (13) | N31—C37—C38—C40 | 177.4 (13) |
| C9—C7—C8—N5 | −179.0 (8) | C39—C37—C38—C40 | −1(2) |
| N7—C7—C8—C10 | 178.3 (8) | O2—S1—C41—F2 | 72.2 (15) |
| C9—C7—C8—C10 | 0.8 (14) | O1—S1—C41—F2 | −46.1 (16) |
| C12—N11—C11—N12 | −180.0 (9) | O3—S1—C41—F2 | −168.7 (14) |
| C12—N11—C11—N10 | 0.5 (14) | O2—S1—C41—F1 | −58.3 (14) |
| N9—N10—C11—N12 | 178.8 (8) | O1—S1—C41—F1 | −176.6 (12) |
| Ag1—N10—C11—N12 | 3.8 (12) | O3—S1—C41—F1 | 60.9 (14) |
| N9—N10—C11—N11 | −1.7 (13) | O2—S1—C41—F3 | −174.1 (9) |
| Ag1—N10—C11—N11 | −176.6 (6) | O1—S1—C41—F3 | 67.6 (11) |
| C11—N11—C12—C13 | 2.1 (14) | O3—S1—C41—F3 | −54.9 (11) |
| C11—N11—C12—C14 | −176.9 (8) | O4—S2—C42—F4 | 38 (2) |
| N10—N9—C13—C12 | 2.3 (13) | O6—S2—C42—F4 | 175.6 (16) |
| N10—N9—C13—C15 | 179.3 (8) | O5—S2—C42—F4 | −70.1 (17) |
| N11—C12—C13—N9 | −3.6 (15) | O4—S2—C42—F5 | 176.9 (15) |
| C14—C12—C13—N9 | 175.4 (9) | O6—S2—C42—F5 | −45.9 (18) |
| N11—C12—C13—C15 | 179.6 (9) | O5—S2—C42—F5 | 68.4 (17) |
| C14—C12—C13—C15 | −1.4 (15) | O4—S2—C42—F6 | −74.1 (13) |
| C17—N15—C16—N14 | −0.2 (14) | O6—S2—C42—F6 | 63.0 (12) |
| C17—N15—C16—N16 | 178.6 (9) | O5—S2—C42—F6 | 177.3 (11) |
| H··· | ||||
| N4—H4A···N5 | 0.86 | 2.15 | 2.977 (9) | 161 |
| N8—H8A···N9 | 0.86 | 2.22 | 3.077 (10) | 173 |
| N12—H12B···N1 | 0.86 | 2.17 | 3.018 (11) | 169 |
| N16—H16B···N17 | 0.86 | 2.21 | 3.052 (10) | 165 |
| N20—H20A···N21 | 0.86 | 2.18 | 3.004 (9) | 161 |
| N24—H24B···N13 | 0.86 | 2.19 | 3.044 (11) | 169 |
| N4—H4B···N30i | 0.86 | 2.10 | 2.935 (11) | 162 |
| N8—H8B···O1ii | 0.86 | 2.19 | 3.032 (11) | 168 |
| N12—H12A···O6iii | 0.86 | 2.26 | 3.047 (11) | 152 |
| N16—H16A···O3iv | 0.86 | 2.23 | 3.032 (11) | 155 |
| N20—H20B···N26ii | 0.86 | 2.15 | 3.003 (9) | 172 |
| N24—H24A···O4 | 0.86 | 2.26 | 3.121 (12) | 175 |
| N28—H28A···N19ii | 0.86 | 2.24 | 3.084 (10) | 167 |
| N28—H28B···O5 | 0.86 | 2.22 | 2.978 (15) | 146 |
| N32—H32A···O2ii | 0.86 | 2.17 | 2.982 (13) | 156 |
| N32—H32B···N3i | 0.86 | 2.30 | 3.142 (12) | 166 |
| C5—H5B···O4 | 0.96 | 2.56 | 3.486 (17) | 161 |
| C9—H9A···N27v | 0.96 | 2.56 | 3.363 (12) | 141 |
| C15—H15B···O3iv | 0.96 | 2.58 | 3.538 (15) | 177 |
| C35—H35C···F1iv | 0.96 | 2.54 | 3.375 (14) | 145 |
| C40—H40A···F5iii | 0.96 | 2.43 | 3.208 (17) | 138 |
| Ag1—N10 | 2.241 (6) |
| Ag1—N6 | 2.248 (6) |
| Ag1—N2 | 2.287 (7) |
| Ag2—N14 | 2.251 (7) |
| Ag2—N18 | 2.264 (6) |
| Ag2—N22 | 2.273 (6) |
| N10—Ag1—N6 | 121.8 (3) |
| N10—Ag1—N2 | 119.6 (3) |
| N6—Ag1—N2 | 118.6 (2) |
| N14—Ag2—N18 | 119.9 (3) |
| N14—Ag2—N22 | 119.5 (3) |
| N18—Ag2—N22 | 120.0 (2) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| N4—H4 | 0.86 | 2.15 | 2.977 (9) | 161 |
| N8—H8 | 0.86 | 2.22 | 3.077 (10) | 173 |
| N12—H12 | 0.86 | 2.17 | 3.018 (11) | 169 |
| N16—H16 | 0.86 | 2.21 | 3.052 (10) | 165 |
| N20—H20 | 0.86 | 2.18 | 3.004 (9) | 161 |
| N24—H24 | 0.86 | 2.19 | 3.044 (11) | 169 |
| N4—H4 | 0.86 | 2.10 | 2.935 (11) | 162 |
| N8—H8 | 0.86 | 2.19 | 3.032 (11) | 168 |
| N12—H12 | 0.86 | 2.26 | 3.047 (11) | 152 |
| N16—H16 | 0.86 | 2.23 | 3.032 (11) | 155 |
| N20—H20 | 0.86 | 2.15 | 3.003 (9) | 172 |
| N24—H24 | 0.86 | 2.26 | 3.121 (12) | 175 |
| N28—H28 | 0.86 | 2.24 | 3.084 (10) | 167 |
| N28—H28 | 0.86 | 2.22 | 2.978 (15) | 146 |
| N32—H32 | 0.86 | 2.17 | 2.982 (13) | 156 |
| N32—H32 | 0.86 | 2.30 | 3.142 (12) | 166 |
| C5—H5 | 0.96 | 2.56 | 3.486 (17) | 161 |
| C9—H9 | 0.96 | 2.56 | 3.363 (12) | 141 |
| C15—H15 | 0.96 | 2.58 | 3.538 (15) | 177 |
| C35—H35 | 0.96 | 2.54 | 3.375 (14) | 145 |
| C40—H40 | 0.96 | 2.43 | 3.208 (17) | 138 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) ; (v) .