| Literature DB >> 22904705 |
Xu Huang, Jing Li, Qi-Ming Qiu, Min Liu, Qiong-Hua Jin.
Abstract
The title complex, [Ag(2)(C(25)H(22)P(2))(2)(C(9)H(7)N)(2)](CF(3)SO(3))(2)·C(9)H(7)Entities:
Year: 2012 PMID: 22904705 PMCID: PMC3414098 DOI: 10.1107/S1600536812029236
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ag2(C25H22P2)2(C9H7N)2](CF3O3S)2·C9H7N | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 4635 reflections | |
| θ = 2.5–28.1° | |
| µ = 0.74 mm−1 | |
| α = 106.696 (1)° | |
| β = 100.382 (1)° | Prism, white |
| γ = 110.289 (2)° | 0.48 × 0.39 × 0.35 mm |
| Bruker SMART 1000 CCD diffractometer | 6407 independent reflections |
| Radiation source: fine-focus sealed tube | 4969 reflections with |
| Graphite monochromator | |
| phi and ω scans | θmax = 25.0°, θmin = 2.5° |
| Absorption correction: multi-scan ( | |
| 9230 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 | |
| 6407 reflections | (Δ/σ)max = 0.001 |
| 497 parameters | Δρmax = 0.63 e Å−3 |
| 0 restraints | Δρmin = −0.57 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 |
| Occ. (<1) | |||||
| Ag1 | 0.52538 (2) | 0.63477 (3) | 0.59947 (2) | 0.04145 (11) | |
| F1 | 0.401 (2) | 0.509 (5) | 0.1002 (15) | 0.115 (8) | 0.57 (12) |
| F2 | 0.194 (4) | 0.430 (4) | 0.0409 (18) | 0.099 (6) | 0.57 (12) |
| F3 | 0.283 (8) | 0.305 (4) | 0.0602 (16) | 0.114 (11) | 0.57 (12) |
| F1' | 0.225 (5) | 0.290 (3) | 0.061 (2) | 0.101 (7) | 0.43 (12) |
| F2' | 0.406 (3) | 0.450 (9) | 0.0954 (18) | 0.123 (12) | 0.43 (12) |
| F3' | 0.233 (7) | 0.462 (6) | 0.037 (2) | 0.095 (9) | 0.43 (12) |
| N1 | 0.5661 (3) | 0.8428 (3) | 0.7245 (2) | 0.0493 (8) | |
| N2 | 0.641 (11) | 0.001 (13) | 0.139 (8) | 0.12 (12) | 0.50 |
| O1 | 0.3089 (4) | 0.6036 (3) | 0.2444 (2) | 0.0848 (11) | |
| O2 | 0.3653 (4) | 0.4369 (4) | 0.2676 (2) | 0.0887 (11) | |
| O3 | 0.1465 (4) | 0.3951 (4) | 0.2050 (3) | 0.1093 (15) | |
| P1 | 0.73017 (8) | 0.71398 (8) | 0.57100 (6) | 0.0300 (2) | |
| P2 | 0.70533 (8) | 0.45711 (8) | 0.44043 (6) | 0.0304 (2) | |
| S1 | 0.27513 (11) | 0.46881 (11) | 0.21639 (7) | 0.0556 (3) | |
| C1 | 0.6518 (4) | 0.8795 (4) | 0.8064 (3) | 0.0489 (10) | |
| H1 | 0.6667 | 0.8162 | 0.8238 | 0.059* | |
| C2 | 0.5452 (4) | 0.9371 (4) | 0.7002 (3) | 0.0606 (12) | |
| H2 | 0.4847 | 0.9123 | 0.6423 | 0.073* | |
| C3 | 0.6075 (4) | 1.0645 (4) | 0.7555 (3) | 0.0618 (12) | |
| H3 | 0.5892 | 1.1247 | 0.7357 | 0.074* | |
| C4 | 0.7006 (4) | 1.1052 (4) | 0.8437 (3) | 0.0551 (11) | |
| C5 | 0.7229 (4) | 1.0103 (4) | 0.8701 (3) | 0.0499 (10) | |
| C6 | 0.8170 (5) | 1.0448 (5) | 0.9551 (3) | 0.0677 (13) | |
| H6 | 0.8317 | 0.9814 | 0.9725 | 0.081* | |
| C7 | 0.8866 (5) | 1.1717 (6) | 1.0119 (4) | 0.0865 (18) | |
| H7 | 0.9491 | 1.1948 | 1.0683 | 0.104* | |
| C8 | 0.8658 (6) | 1.2661 (6) | 0.9871 (4) | 0.0915 (19) | |
| H8 | 0.9150 | 1.3523 | 1.0269 | 0.110* | |
| C9 | 0.7745 (5) | 1.2365 (5) | 0.9052 (4) | 0.0777 (16) | |
| H9 | 0.7609 | 1.3018 | 0.8899 | 0.093* | |
| C10 | 0.8032 (3) | 0.5997 (3) | 0.5509 (2) | 0.0325 (8) | |
| H10A | 0.8122 | 0.5727 | 0.6044 | 0.039* | |
| H10B | 0.8876 | 0.6419 | 0.5465 | 0.039* | |
| C11 | 0.8524 (3) | 0.8601 (3) | 0.6680 (2) | 0.0356 (8) | |
| C12 | 0.8431 (4) | 0.9755 (4) | 0.6772 (3) | 0.0443 (9) | |
| H12 | 0.7779 | 0.9761 | 0.6334 | 0.053* | |
| C13 | 0.9295 (4) | 1.0896 (4) | 0.7509 (3) | 0.0587 (12) | |
| H13 | 0.9222 | 1.1664 | 0.7565 | 0.070* | |
| C14 | 1.0252 (5) | 1.0893 (5) | 0.8153 (3) | 0.0699 (15) | |
| H14 | 1.0841 | 1.1662 | 0.8644 | 0.084* | |
| C15 | 1.0349 (4) | 0.9760 (5) | 0.8078 (3) | 0.0684 (14) | |
| H15 | 1.0999 | 0.9766 | 0.8525 | 0.082* | |
| C16 | 0.9488 (4) | 0.8598 (4) | 0.7342 (3) | 0.0509 (10) | |
| H16 | 0.9560 | 0.7833 | 0.7296 | 0.061* | |
| C17 | 0.7319 (3) | 0.7611 (3) | 0.4689 (2) | 0.0335 (8) | |
| C18 | 0.8460 (3) | 0.8180 (4) | 0.4524 (3) | 0.0412 (9) | |
| H18 | 0.9223 | 0.8355 | 0.4953 | 0.049* | |
| C19 | 0.8473 (4) | 0.8488 (4) | 0.3733 (3) | 0.0530 (11) | |
| H19 | 0.9244 | 0.8875 | 0.3630 | 0.064* | |
| C20 | 0.7351 (5) | 0.8226 (4) | 0.3095 (3) | 0.0579 (12) | |
| H20 | 0.7362 | 0.8430 | 0.2557 | 0.069* | |
| C21 | 0.6221 (5) | 0.7669 (4) | 0.3246 (3) | 0.0588 (12) | |
| H21 | 0.5462 | 0.7488 | 0.2808 | 0.071* | |
| C22 | 0.6197 (4) | 0.7370 (4) | 0.4048 (3) | 0.0439 (9) | |
| H22 | 0.5425 | 0.7007 | 0.4156 | 0.053* | |
| C23 | 0.7693 (3) | 0.4931 (3) | 0.3477 (2) | 0.0335 (8) | |
| C24 | 0.8969 (4) | 0.5276 (4) | 0.3545 (3) | 0.0482 (10) | |
| H24 | 0.9537 | 0.5361 | 0.4090 | 0.058* | |
| C25 | 0.9397 (4) | 0.5496 (4) | 0.2798 (3) | 0.0609 (12) | |
| H25 | 1.0247 | 0.5706 | 0.2837 | 0.073* | |
| C26 | 0.8566 (5) | 0.5401 (4) | 0.2009 (3) | 0.0664 (14) | |
| H26 | 0.8857 | 0.5556 | 0.1514 | 0.080* | |
| C27 | 0.7308 (5) | 0.5080 (4) | 0.1941 (3) | 0.0601 (12) | |
| H27 | 0.6752 | 0.5028 | 0.1403 | 0.072* | |
| C28 | 0.6864 (4) | 0.4834 (4) | 0.2666 (3) | 0.0440 (9) | |
| H28 | 0.6007 | 0.4602 | 0.2612 | 0.053* | |
| C29 | 0.7519 (3) | 0.3338 (3) | 0.4608 (2) | 0.0341 (8) | |
| C30 | 0.7968 (3) | 0.2631 (4) | 0.3987 (3) | 0.0419 (9) | |
| H30 | 0.8126 | 0.2836 | 0.3470 | 0.050* | |
| C31 | 0.8182 (4) | 0.1615 (4) | 0.4140 (3) | 0.0517 (10) | |
| H31 | 0.8483 | 0.1145 | 0.3723 | 0.062* | |
| C32 | 0.7953 (4) | 0.1303 (4) | 0.4895 (3) | 0.0565 (11) | |
| H32 | 0.8093 | 0.0620 | 0.4990 | 0.068* | |
| C33 | 0.7515 (4) | 0.1998 (4) | 0.5517 (3) | 0.0553 (11) | |
| H33 | 0.7370 | 0.1791 | 0.6036 | 0.066* | |
| C34 | 0.7290 (4) | 0.3006 (4) | 0.5373 (3) | 0.0433 (9) | |
| H34 | 0.6982 | 0.3465 | 0.5791 | 0.052* | |
| C35 | 0.2884 (7) | 0.4224 (6) | 0.0981 (4) | 0.0783 (16) | |
| C36 | 0.641 (14) | 0.001 (15) | 0.139 (10) | 0.12 (14) | 0.50 |
| H36 | 0.7001 | 0.0233 | 0.1969 | 0.144* | 0.50 |
| C37 | 0.6164 (7) | 0.0911 (10) | 0.1179 (5) | 0.118 (3) | |
| H37 | 0.6571 | 0.1756 | 0.1623 | 0.142* | |
| C38 | 0.5330 (5) | 0.0643 (6) | 0.0327 (4) | 0.0837 (18) | |
| C39 | 0.5054 (8) | 0.1618 (8) | 0.0075 (6) | 0.115 (2) | |
| H39 | 0.5456 | 0.2481 | 0.0487 | 0.137* | |
| C40 | 0.4179 (8) | 0.1228 (10) | −0.0790 (7) | 0.115 (3) | |
| H40 | 0.3988 | 0.1841 | −0.0966 | 0.138* |
| Ag1 | 0.03004 (16) | 0.04394 (19) | 0.04563 (19) | 0.01163 (13) | 0.01270 (12) | 0.01485 (13) |
| F1 | 0.135 (9) | 0.147 (18) | 0.098 (6) | 0.068 (10) | 0.082 (6) | 0.057 (8) |
| F2 | 0.128 (14) | 0.105 (10) | 0.051 (5) | 0.035 (10) | 0.003 (7) | 0.045 (5) |
| F3 | 0.17 (3) | 0.111 (11) | 0.079 (5) | 0.102 (18) | 0.034 (11) | 0.014 (5) |
| F1' | 0.111 (17) | 0.098 (9) | 0.076 (7) | 0.068 (10) | 0.008 (8) | −0.007 (6) |
| F2' | 0.116 (10) | 0.16 (3) | 0.110 (9) | 0.069 (15) | 0.063 (8) | 0.034 (14) |
| F3' | 0.14 (2) | 0.099 (17) | 0.055 (6) | 0.057 (16) | 0.026 (11) | 0.039 (9) |
| N1 | 0.0474 (19) | 0.041 (2) | 0.046 (2) | 0.0123 (16) | 0.0156 (16) | 0.0056 (16) |
| N2 | 0.10 (18) | 0.2 (3) | 0.1 (2) | 0.06 (18) | 0.03 (15) | 0.03 (19) |
| O1 | 0.111 (3) | 0.057 (2) | 0.070 (2) | 0.032 (2) | 0.020 (2) | 0.0112 (17) |
| O2 | 0.099 (3) | 0.094 (3) | 0.065 (2) | 0.040 (2) | −0.0066 (19) | 0.039 (2) |
| O3 | 0.077 (3) | 0.116 (3) | 0.101 (3) | 0.003 (2) | 0.025 (2) | 0.044 (3) |
| P1 | 0.0269 (4) | 0.0286 (5) | 0.0297 (5) | 0.0088 (4) | 0.0092 (4) | 0.0081 (4) |
| P2 | 0.0277 (4) | 0.0300 (5) | 0.0302 (5) | 0.0111 (4) | 0.0088 (4) | 0.0081 (4) |
| S1 | 0.0579 (7) | 0.0556 (7) | 0.0409 (6) | 0.0125 (5) | 0.0092 (5) | 0.0192 (5) |
| C1 | 0.058 (3) | 0.040 (2) | 0.046 (2) | 0.017 (2) | 0.024 (2) | 0.0137 (19) |
| C2 | 0.046 (3) | 0.060 (3) | 0.060 (3) | 0.019 (2) | 0.011 (2) | 0.010 (2) |
| C3 | 0.056 (3) | 0.052 (3) | 0.077 (3) | 0.030 (2) | 0.018 (2) | 0.018 (2) |
| C4 | 0.054 (3) | 0.040 (2) | 0.060 (3) | 0.017 (2) | 0.024 (2) | 0.005 (2) |
| C5 | 0.054 (2) | 0.045 (2) | 0.041 (2) | 0.013 (2) | 0.0222 (19) | 0.0076 (19) |
| C6 | 0.076 (3) | 0.061 (3) | 0.049 (3) | 0.015 (3) | 0.018 (2) | 0.015 (2) |
| C7 | 0.081 (4) | 0.078 (4) | 0.053 (3) | 0.004 (3) | 0.013 (3) | 0.000 (3) |
| C8 | 0.089 (4) | 0.054 (4) | 0.077 (4) | 0.004 (3) | 0.019 (3) | −0.015 (3) |
| C9 | 0.077 (4) | 0.046 (3) | 0.089 (4) | 0.019 (3) | 0.027 (3) | 0.003 (3) |
| C10 | 0.0318 (18) | 0.0319 (19) | 0.0309 (18) | 0.0119 (15) | 0.0092 (14) | 0.0103 (15) |
| C11 | 0.0324 (18) | 0.033 (2) | 0.0344 (19) | 0.0063 (15) | 0.0166 (15) | 0.0091 (15) |
| C12 | 0.043 (2) | 0.038 (2) | 0.042 (2) | 0.0089 (18) | 0.0196 (17) | 0.0094 (17) |
| C13 | 0.061 (3) | 0.037 (2) | 0.054 (3) | 0.002 (2) | 0.026 (2) | 0.002 (2) |
| C14 | 0.068 (3) | 0.050 (3) | 0.047 (3) | −0.009 (2) | 0.020 (2) | −0.004 (2) |
| C15 | 0.054 (3) | 0.080 (4) | 0.038 (2) | 0.008 (3) | 0.000 (2) | 0.012 (2) |
| C16 | 0.047 (2) | 0.050 (3) | 0.040 (2) | 0.011 (2) | 0.0058 (18) | 0.0106 (19) |
| C17 | 0.0355 (19) | 0.0293 (19) | 0.0319 (18) | 0.0119 (15) | 0.0121 (15) | 0.0073 (15) |
| C18 | 0.040 (2) | 0.042 (2) | 0.041 (2) | 0.0151 (18) | 0.0146 (17) | 0.0155 (17) |
| C19 | 0.062 (3) | 0.048 (3) | 0.050 (2) | 0.016 (2) | 0.028 (2) | 0.022 (2) |
| C20 | 0.080 (3) | 0.051 (3) | 0.043 (2) | 0.023 (2) | 0.018 (2) | 0.024 (2) |
| C21 | 0.065 (3) | 0.058 (3) | 0.045 (2) | 0.026 (2) | 0.001 (2) | 0.019 (2) |
| C22 | 0.039 (2) | 0.043 (2) | 0.048 (2) | 0.0166 (18) | 0.0090 (17) | 0.0180 (18) |
| C23 | 0.0374 (19) | 0.0305 (19) | 0.0347 (19) | 0.0159 (16) | 0.0147 (15) | 0.0110 (15) |
| C24 | 0.043 (2) | 0.050 (2) | 0.048 (2) | 0.0163 (19) | 0.0166 (18) | 0.0155 (19) |
| C25 | 0.055 (3) | 0.058 (3) | 0.069 (3) | 0.017 (2) | 0.037 (2) | 0.021 (2) |
| C26 | 0.090 (4) | 0.058 (3) | 0.046 (3) | 0.020 (3) | 0.037 (3) | 0.017 (2) |
| C27 | 0.074 (3) | 0.062 (3) | 0.038 (2) | 0.022 (2) | 0.013 (2) | 0.021 (2) |
| C28 | 0.046 (2) | 0.045 (2) | 0.038 (2) | 0.0181 (19) | 0.0117 (17) | 0.0152 (17) |
| C29 | 0.0289 (17) | 0.0313 (19) | 0.0349 (19) | 0.0094 (15) | 0.0073 (15) | 0.0085 (15) |
| C30 | 0.044 (2) | 0.042 (2) | 0.039 (2) | 0.0192 (18) | 0.0142 (17) | 0.0125 (17) |
| C31 | 0.060 (3) | 0.046 (2) | 0.057 (3) | 0.032 (2) | 0.023 (2) | 0.017 (2) |
| C32 | 0.068 (3) | 0.047 (3) | 0.063 (3) | 0.033 (2) | 0.018 (2) | 0.023 (2) |
| C33 | 0.073 (3) | 0.052 (3) | 0.051 (2) | 0.029 (2) | 0.023 (2) | 0.028 (2) |
| C34 | 0.048 (2) | 0.043 (2) | 0.044 (2) | 0.0236 (19) | 0.0178 (18) | 0.0159 (18) |
| C35 | 0.109 (5) | 0.082 (4) | 0.051 (3) | 0.049 (4) | 0.022 (3) | 0.026 (3) |
| C36 | 0.1 (2) | 0.2 (4) | 0.1 (3) | 0.1 (2) | 0.03 (18) | 0.0 (2) |
| C37 | 0.095 (5) | 0.150 (8) | 0.081 (5) | 0.041 (5) | 0.030 (4) | 0.017 (5) |
| C38 | 0.064 (3) | 0.122 (5) | 0.055 (3) | 0.037 (3) | 0.030 (3) | 0.015 (3) |
| C39 | 0.115 (6) | 0.118 (6) | 0.099 (6) | 0.046 (5) | 0.049 (5) | 0.020 (5) |
| C40 | 0.123 (7) | 0.138 (8) | 0.108 (7) | 0.070 (6) | 0.052 (6) | 0.053 (6) |
| Ag1—P2i | 2.4296 (9) | C14—H14 | 0.9300 |
| Ag1—P1 | 2.4368 (9) | C15—C16 | 1.394 (6) |
| Ag1—N1 | 2.489 (3) | C15—H15 | 0.9300 |
| F1—C35 | 1.35 (2) | C16—H16 | 0.9300 |
| F2—C35 | 1.34 (3) | C17—C22 | 1.381 (5) |
| F3—C35 | 1.33 (2) | C17—C18 | 1.386 (5) |
| F1'—C35 | 1.37 (3) | C18—C19 | 1.371 (6) |
| F2'—C35 | 1.32 (3) | C18—H18 | 0.9300 |
| F3'—C35 | 1.33 (4) | C19—C20 | 1.371 (6) |
| N1—C1 | 1.312 (5) | C19—H19 | 0.9300 |
| N1—C2 | 1.366 (6) | C20—C21 | 1.361 (6) |
| N2—C37 | 1.32 (13) | C20—H20 | 0.9300 |
| N2—C40ii | 1.33 (13) | C21—C22 | 1.385 (6) |
| O1—S1 | 1.423 (4) | C21—H21 | 0.9300 |
| O2—S1 | 1.430 (3) | C22—H22 | 0.9300 |
| O3—S1 | 1.411 (4) | C23—C24 | 1.388 (5) |
| P1—C17 | 1.818 (4) | C23—C28 | 1.388 (5) |
| P1—C11 | 1.825 (3) | C24—C25 | 1.392 (6) |
| P1—C10 | 1.833 (3) | C24—H24 | 0.9300 |
| P2—C23 | 1.820 (4) | C25—C26 | 1.366 (7) |
| P2—C29 | 1.823 (4) | C25—H25 | 0.9300 |
| P2—C10 | 1.841 (3) | C26—C27 | 1.371 (7) |
| P2—Ag1i | 2.4296 (9) | C26—H26 | 0.9300 |
| S1—C35 | 1.800 (5) | C27—C28 | 1.380 (6) |
| C1—C5 | 1.420 (5) | C27—H27 | 0.9300 |
| C1—H1 | 0.9300 | C28—H28 | 0.9300 |
| C2—C3 | 1.353 (6) | C29—C34 | 1.388 (5) |
| C2—H2 | 0.9300 | C29—C30 | 1.391 (5) |
| C3—C4 | 1.414 (6) | C30—C31 | 1.393 (5) |
| C3—H3 | 0.9300 | C30—H30 | 0.9300 |
| C4—C5 | 1.396 (6) | C31—C32 | 1.364 (6) |
| C4—C9 | 1.420 (6) | C31—H31 | 0.9300 |
| C5—C6 | 1.401 (6) | C32—C33 | 1.374 (6) |
| C6—C7 | 1.360 (7) | C32—H32 | 0.9300 |
| C6—H6 | 0.9300 | C33—C34 | 1.386 (5) |
| C7—C8 | 1.371 (8) | C33—H33 | 0.9300 |
| C7—H7 | 0.9300 | C34—H34 | 0.9300 |
| C8—C9 | 1.365 (8) | C36—C37 | 1.32 (15) |
| C8—H8 | 0.9300 | C36—C40ii | 1.33 (15) |
| C9—H9 | 0.9300 | C36—H36 | 0.9300 |
| C10—H10A | 0.9700 | C37—C38 | 1.367 (9) |
| C10—H10B | 0.9700 | C37—H37 | 0.9300 |
| C11—C16 | 1.384 (5) | C38—C38ii | 1.406 (12) |
| C11—C12 | 1.387 (5) | C38—C39 | 1.443 (10) |
| C12—C13 | 1.383 (5) | C39—C40 | 1.369 (10) |
| C12—H12 | 0.9300 | C39—H39 | 0.9300 |
| C13—C14 | 1.363 (7) | C40—N2ii | 1.33 (13) |
| C13—H13 | 0.9300 | C40—C36ii | 1.33 (15) |
| C14—C15 | 1.369 (7) | C40—H40 | 0.9300 |
| P2i—Ag1—P1 | 156.44 (3) | C21—C20—H20 | 119.9 |
| P2i—Ag1—N1 | 96.13 (8) | C19—C20—H20 | 119.9 |
| P1—Ag1—N1 | 95.55 (8) | C20—C21—C22 | 120.2 (4) |
| C1—N1—C2 | 117.3 (4) | C20—C21—H21 | 119.9 |
| C1—N1—Ag1 | 116.6 (3) | C22—C21—H21 | 119.9 |
| C2—N1—Ag1 | 120.8 (3) | C17—C22—C21 | 120.1 (4) |
| C37—N2—C40ii | 122 (8) | C17—C22—H22 | 119.9 |
| C17—P1—C11 | 101.96 (16) | C21—C22—H22 | 119.9 |
| C17—P1—C10 | 102.83 (16) | C24—C23—C28 | 119.1 (3) |
| C11—P1—C10 | 104.74 (16) | C24—C23—P2 | 122.4 (3) |
| C17—P1—Ag1 | 116.50 (12) | C28—C23—P2 | 118.4 (3) |
| C11—P1—Ag1 | 114.01 (11) | C23—C24—C25 | 120.0 (4) |
| C10—P1—Ag1 | 115.11 (12) | C23—C24—H24 | 120.0 |
| C23—P2—C29 | 105.89 (16) | C25—C24—H24 | 120.0 |
| C23—P2—C10 | 105.53 (16) | C26—C25—C24 | 119.9 (4) |
| C29—P2—C10 | 102.69 (16) | C26—C25—H25 | 120.0 |
| C23—P2—Ag1i | 115.97 (12) | C24—C25—H25 | 120.0 |
| C29—P2—Ag1i | 105.64 (11) | C25—C26—C27 | 120.6 (4) |
| C10—P2—Ag1i | 119.53 (11) | C25—C26—H26 | 119.7 |
| O3—S1—O1 | 113.6 (3) | C27—C26—H26 | 119.7 |
| O3—S1—O2 | 115.2 (3) | C26—C27—C28 | 120.2 (4) |
| O1—S1—O2 | 114.5 (2) | C26—C27—H27 | 119.9 |
| O3—S1—C35 | 104.9 (3) | C28—C27—H27 | 119.9 |
| O1—S1—C35 | 103.5 (3) | C27—C28—C23 | 120.2 (4) |
| O2—S1—C35 | 103.2 (3) | C27—C28—H28 | 119.9 |
| N1—C1—C5 | 123.8 (4) | C23—C28—H28 | 119.9 |
| N1—C1—H1 | 118.1 | C34—C29—C30 | 118.6 (3) |
| C5—C1—H1 | 118.1 | C34—C29—P2 | 117.6 (3) |
| C3—C2—N1 | 123.8 (4) | C30—C29—P2 | 123.4 (3) |
| C3—C2—H2 | 118.1 | C29—C30—C31 | 120.1 (4) |
| N1—C2—H2 | 118.1 | C29—C30—H30 | 120.0 |
| C2—C3—C4 | 119.4 (4) | C31—C30—H30 | 120.0 |
| C2—C3—H3 | 120.3 | C32—C31—C30 | 120.5 (4) |
| C4—C3—H3 | 120.3 | C32—C31—H31 | 119.7 |
| C5—C4—C3 | 117.7 (4) | C30—C31—H31 | 119.7 |
| C5—C4—C9 | 118.4 (5) | C31—C32—C33 | 120.0 (4) |
| C3—C4—C9 | 123.8 (5) | C31—C32—H32 | 120.0 |
| C4—C5—C6 | 120.4 (4) | C33—C32—H32 | 120.0 |
| C4—C5—C1 | 118.0 (4) | C32—C33—C34 | 120.2 (4) |
| C6—C5—C1 | 121.5 (4) | C32—C33—H33 | 119.9 |
| C7—C6—C5 | 119.5 (5) | C34—C33—H33 | 119.9 |
| C7—C6—H6 | 120.2 | C33—C34—C29 | 120.5 (4) |
| C5—C6—H6 | 120.2 | C33—C34—H34 | 119.7 |
| C6—C7—C8 | 120.8 (6) | C29—C34—H34 | 119.7 |
| C6—C7—H7 | 119.6 | F2'—C35—F3 | 78.7 (12) |
| C8—C7—H7 | 119.6 | F2'—C35—F3' | 107.9 (18) |
| C9—C8—C7 | 121.5 (5) | F3—C35—F3' | 115.2 (17) |
| C9—C8—H8 | 119.3 | F2'—C35—F2 | 128.4 (16) |
| C7—C8—H8 | 119.3 | F3—C35—F2 | 108 (2) |
| C8—C9—C4 | 119.3 (5) | F3'—C35—F2 | 22 (2) |
| C8—C9—H9 | 120.3 | F2'—C35—F1 | 31.0 (17) |
| C4—C9—H9 | 120.3 | F3—C35—F1 | 108.1 (12) |
| P1—C10—P2 | 110.79 (17) | F3'—C35—F1 | 86 (2) |
| P1—C10—H10A | 109.5 | F2—C35—F1 | 108.4 (12) |
| P2—C10—H10A | 109.5 | F2'—C35—F1' | 106.4 (17) |
| P1—C10—H10B | 109.5 | F3—C35—F1' | 27.7 (13) |
| P2—C10—H10B | 109.5 | F3'—C35—F1' | 106 (2) |
| H10A—C10—H10B | 108.1 | F2—C35—F1' | 90.4 (14) |
| C16—C11—C12 | 119.2 (3) | F1—C35—F1' | 135.2 (10) |
| C16—C11—P1 | 123.3 (3) | F2'—C35—S1 | 114.4 (11) |
| C12—C11—P1 | 117.3 (3) | F3—C35—S1 | 116.3 (13) |
| C13—C12—C11 | 120.8 (4) | F3'—C35—S1 | 117.7 (18) |
| C13—C12—H12 | 119.6 | F2—C35—S1 | 107.8 (17) |
| C11—C12—H12 | 119.6 | F1—C35—S1 | 108.0 (13) |
| C14—C13—C12 | 119.8 (5) | F1'—C35—S1 | 104 (2) |
| C14—C13—H13 | 120.1 | C37—C36—C40ii | 122 (10) |
| C12—C13—H13 | 120.1 | C37—C36—H36 | 119.2 |
| C13—C14—C15 | 120.1 (4) | C40ii—C36—H36 | 119.2 |
| C13—C14—H14 | 120.0 | C36—C37—N2 | 0 (10) |
| C15—C14—H14 | 120.0 | C36—C37—C38 | 122 (6) |
| C14—C15—C16 | 121.0 (5) | N2—C37—C38 | 122 (5) |
| C14—C15—H15 | 119.5 | C36—C37—H37 | 119.0 |
| C16—C15—H15 | 119.5 | N2—C37—H37 | 119.1 |
| C11—C16—C15 | 119.0 (4) | C38—C37—H37 | 119.1 |
| C11—C16—H16 | 120.5 | C37—C38—C38ii | 119.1 (9) |
| C15—C16—H16 | 120.5 | C37—C38—C39 | 123.0 (7) |
| C22—C17—C18 | 118.8 (3) | C38ii—C38—C39 | 117.9 (8) |
| C22—C17—P1 | 120.8 (3) | C40—C39—C38 | 117.7 (7) |
| C18—C17—P1 | 120.3 (3) | C40—C39—H39 | 121.2 |
| C19—C18—C17 | 120.6 (4) | C38—C39—H39 | 121.2 |
| C19—C18—H18 | 119.7 | N2ii—C40—C36ii | 0 (10) |
| C17—C18—H18 | 119.7 | N2ii—C40—C39 | 122 (5) |
| C20—C19—C18 | 120.0 (4) | C36ii—C40—C39 | 122 (6) |
| C20—C19—H19 | 120.0 | N2ii—C40—H40 | 119.0 |
| C18—C19—H19 | 120.0 | C36ii—C40—H40 | 119.1 |
| C21—C20—C19 | 120.3 (4) | C39—C40—H40 | 119.0 |
| P2i—Ag1—N1—C1 | 130.6 (3) | C18—C17—C22—C21 | 1.5 (6) |
| P1—Ag1—N1—C1 | −69.9 (3) | P1—C17—C22—C21 | −176.4 (3) |
| P2i—Ag1—N1—C2 | −76.1 (3) | C20—C21—C22—C17 | −1.4 (6) |
| P1—Ag1—N1—C2 | 83.4 (3) | C29—P2—C23—C24 | −53.5 (3) |
| P2i—Ag1—P1—C17 | 20.80 (16) | C10—P2—C23—C24 | 55.0 (3) |
| N1—Ag1—P1—C17 | −98.62 (15) | Ag1i—P2—C23—C24 | −170.2 (3) |
| P2i—Ag1—P1—C11 | 139.21 (15) | C29—P2—C23—C28 | 125.5 (3) |
| N1—Ag1—P1—C11 | 19.79 (16) | C10—P2—C23—C28 | −126.1 (3) |
| P2i—Ag1—P1—C10 | −99.70 (14) | Ag1i—P2—C23—C28 | 8.7 (3) |
| N1—Ag1—P1—C10 | 140.87 (15) | C28—C23—C24—C25 | −1.2 (6) |
| C2—N1—C1—C5 | −0.1 (6) | P2—C23—C24—C25 | 177.7 (3) |
| Ag1—N1—C1—C5 | 154.2 (3) | C23—C24—C25—C26 | 1.6 (6) |
| C1—N1—C2—C3 | 0.0 (6) | C24—C25—C26—C27 | −0.6 (7) |
| Ag1—N1—C2—C3 | −153.2 (4) | C25—C26—C27—C28 | −0.8 (7) |
| N1—C2—C3—C4 | 0.4 (7) | C26—C27—C28—C23 | 1.1 (6) |
| C2—C3—C4—C5 | −0.7 (7) | C24—C23—C28—C27 | −0.1 (6) |
| C2—C3—C4—C9 | 177.5 (4) | P2—C23—C28—C27 | −179.1 (3) |
| C3—C4—C5—C6 | 177.8 (4) | C23—P2—C29—C34 | 171.9 (3) |
| C9—C4—C5—C6 | −0.5 (6) | C10—P2—C29—C34 | 61.4 (3) |
| C3—C4—C5—C1 | 0.6 (6) | Ag1i—P2—C29—C34 | −64.5 (3) |
| C9—C4—C5—C1 | −177.7 (4) | C23—P2—C29—C30 | −14.8 (3) |
| N1—C1—C5—C4 | −0.2 (6) | C10—P2—C29—C30 | −125.2 (3) |
| N1—C1—C5—C6 | −177.4 (4) | Ag1i—P2—C29—C30 | 108.8 (3) |
| C4—C5—C6—C7 | 0.0 (7) | C34—C29—C30—C31 | −0.1 (5) |
| C1—C5—C6—C7 | 177.1 (4) | P2—C29—C30—C31 | −173.4 (3) |
| C5—C6—C7—C8 | 0.1 (8) | C29—C30—C31—C32 | 0.1 (6) |
| C6—C7—C8—C9 | 0.4 (9) | C30—C31—C32—C33 | −0.4 (7) |
| C7—C8—C9—C4 | −0.9 (9) | C31—C32—C33—C34 | 0.8 (7) |
| C5—C4—C9—C8 | 0.9 (7) | C32—C33—C34—C29 | −0.9 (6) |
| C3—C4—C9—C8 | −177.3 (5) | C30—C29—C34—C33 | 0.6 (5) |
| C17—P1—C10—P2 | −63.0 (2) | P2—C29—C34—C33 | 174.2 (3) |
| C11—P1—C10—P2 | −169.23 (18) | O3—S1—C35—F2' | −161 (5) |
| Ag1—P1—C10—P2 | 64.76 (19) | O1—S1—C35—F2' | 80 (5) |
| C23—P2—C10—P1 | 93.0 (2) | O2—S1—C35—F2' | −40 (5) |
| C29—P2—C10—P1 | −156.24 (18) | O3—S1—C35—F3 | −72 (4) |
| Ag1i—P2—C10—P1 | −39.8 (2) | O1—S1—C35—F3 | 169 (4) |
| C17—P1—C11—C16 | −131.7 (3) | O2—S1—C35—F3 | 49 (4) |
| C10—P1—C11—C16 | −24.8 (3) | O3—S1—C35—F3' | 71 (4) |
| Ag1—P1—C11—C16 | 101.9 (3) | O1—S1—C35—F3' | −48 (4) |
| C17—P1—C11—C12 | 51.4 (3) | O2—S1—C35—F3' | −168 (4) |
| C10—P1—C11—C12 | 158.3 (3) | O3—S1—C35—F2 | 50 (2) |
| Ag1—P1—C11—C12 | −75.0 (3) | O1—S1—C35—F2 | −70 (2) |
| C16—C11—C12—C13 | 0.7 (5) | O2—S1—C35—F2 | 171 (2) |
| P1—C11—C12—C13 | 177.7 (3) | O3—S1—C35—F1 | 167 (3) |
| C11—C12—C13—C14 | 0.1 (6) | O1—S1—C35—F1 | 47 (3) |
| C12—C13—C14—C15 | −0.9 (7) | O2—S1—C35—F1 | −72 (3) |
| C13—C14—C15—C16 | 0.8 (7) | O3—S1—C35—F1' | −45 (2) |
| C12—C11—C16—C15 | −0.8 (6) | O1—S1—C35—F1' | −165 (2) |
| P1—C11—C16—C15 | −177.6 (3) | O2—S1—C35—F1' | 76 (2) |
| C14—C15—C16—C11 | 0.0 (7) | C40ii—C36—C37—N2 | −38 (100) |
| C11—P1—C17—C22 | −132.8 (3) | C40ii—C36—C37—C38 | −2 (16) |
| C10—P1—C17—C22 | 118.8 (3) | C40ii—N2—C37—C36 | 142 (100) |
| Ag1—P1—C17—C22 | −8.0 (3) | C40ii—N2—C37—C38 | −2 (13) |
| C11—P1—C17—C18 | 49.4 (3) | C36—C37—C38—C38ii | 3 (8) |
| C10—P1—C17—C18 | −59.0 (3) | N2—C37—C38—C38ii | 3 (7) |
| Ag1—P1—C17—C18 | 174.2 (2) | C36—C37—C38—C39 | −180 (8) |
| C22—C17—C18—C19 | −0.6 (5) | N2—C37—C38—C39 | −179 (6) |
| P1—C17—C18—C19 | 177.3 (3) | C37—C38—C39—C40 | −178.5 (7) |
| C17—C18—C19—C20 | −0.4 (6) | C38ii—C38—C39—C40 | −0.9 (10) |
| C18—C19—C20—C21 | 0.5 (7) | C38—C39—C40—N2ii | 0 (6) |
| C19—C20—C21—C22 | 0.4 (7) | C38—C39—C40—C36ii | 0 (8) |