| Literature DB >> 21580906 |
Cao-Yuan Niu1, Xin-Sheng Wan, Xiao-Wei Gui, Zhan-Guo Cao, Chun-Hong Kou.
Abstract
In the title compound, {[Ag(C(14)H(10)N(4)O)(2)]CF(3)SO(3)}(n), the unique Ag(I) ion is coordinated by two N atoms from two pyridine rings of two independent N'-(4-cyano-benzyl-idene)nicotinohydrazide ligands and one N atom of a carbonitrile group of a symmetry-related N'-(4-cyano-benzyl-idene)nicotino-hydrazide ligand, forming a distorted T-shaped coordination environment. One of the independent ligands acts as a bridge connecting Ag(I) ions, forming chains along the a axis. In the crystal structure, two neighbouring anti-parallel chains are connected through N-H⋯O hydrogen bonds. In addition, there are relatively short Ag⋯O contacts of 2.723 (3) Å, which connect the chains into a three-dimensional structure.Entities:
Year: 2008 PMID: 21580906 PMCID: PMC2959788 DOI: 10.1107/S1600536808034685
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ag(C14H10N4O)2]CF3SO3 | |
| Monoclinic, | Mo |
| Hall symbol: -C 2yc | Cell parameters from 5153 reflections |
| θ = 2.1–27.5° | |
| µ = 0.80 mm−1 | |
| β = 98.437 (2)° | Prism, colourless |
| 0.51 × 0.32 × 0.27 mm | |
| Siemens SMART CCD diffractometer | 6990 independent reflections |
| Radiation source: fine-focus sealed tube | 5059 reflections with |
| graphite | |
| φ and ω scans | θmax = 27.5°, θmin = 2.1° |
| Absorption correction: multi-scan (SADABS; Sheldrick, 1996) | |
| 19396 measured reflections |
| Refinement on | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| Hydrogen site location: inferred from neighbouring sites | |
| H atoms treated by a mixture of independent and constrained refinement | |
| 6990 reflections | (Δ/σ)max < 0.001 |
| 432 parameters | Δρmax = 1.47 e Å−3 |
| 22 restraints | Δρmin = −0.79 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 | 0.177461 (13) | 0.31617 (2) | 0.21259 (2) | 0.05965 (14) | |
| N1 | 0.16489 (13) | 0.4710 (2) | 0.22045 (18) | 0.0481 (7) | |
| N2 | 0.19741 (12) | 0.17730 (19) | 0.16389 (17) | 0.0421 (6) | |
| N3 | 0.25625 (13) | 0.6644 (2) | 0.10836 (19) | 0.0488 (7) | |
| N4 | 0.29258 (12) | 0.7215 (2) | 0.07857 (19) | 0.0497 (7) | |
| N5 | 0.5169 (2) | 0.9140 (4) | −0.1204 (3) | 0.1027 (17) | |
| N6 | 0.32032 (13) | 0.1492 (2) | 0.02428 (18) | 0.0480 (7) | |
| N7 | 0.35916 (12) | 0.1432 (2) | −0.02381 (18) | 0.0491 (7) | |
| N8 | 0.60476 (14) | 0.2456 (3) | −0.2154 (2) | 0.0662 (10) | |
| S1 | 0.35594 (5) | 0.41766 (7) | 0.11529 (6) | 0.0575 (3) | |
| O1 | 0.23222 (12) | 0.78306 (19) | 0.18438 (17) | 0.0603 (7) | |
| O2 | 0.28597 (11) | 0.0026 (2) | −0.01063 (16) | 0.0589 (7) | |
| O3 | 0.33416 (17) | 0.3230 (2) | 0.1160 (2) | 0.0852 (11) | |
| O4 | 0.32654 (16) | 0.4890 (3) | 0.1495 (2) | 0.0886 (11) | |
| O5 | 0.37379 (17) | 0.4448 (2) | 0.04515 (19) | 0.0852 (11) | |
| F1 | 0.4489 (2) | 0.3413 (5) | 0.1600 (3) | 0.180 (2) | |
| F2 | 0.40950 (15) | 0.3851 (3) | 0.2507 (2) | 0.1073 (11) | |
| F3 | 0.4445 (2) | 0.4874 (4) | 0.1883 (3) | 0.180 (2) | |
| C1 | 0.12856 (16) | 0.5082 (3) | 0.2610 (2) | 0.0548 (10) | |
| H1 | 0.1059 | 0.4658 | 0.2839 | 0.066* | |
| C2 | 0.12275 (17) | 0.6049 (3) | 0.2707 (3) | 0.0611 (11) | |
| H2 | 0.0966 | 0.6289 | 0.2998 | 0.073* | |
| C3 | 0.15543 (18) | 0.6664 (3) | 0.2376 (3) | 0.0562 (10) | |
| H3 | 0.1524 | 0.7336 | 0.2444 | 0.067* | |
| C4 | 0.19279 (14) | 0.6307 (2) | 0.19433 (19) | 0.0410 (7) | |
| C5 | 0.19597 (15) | 0.5322 (3) | 0.1878 (2) | 0.0452 (8) | |
| H5 | 0.2216 | 0.5065 | 0.1585 | 0.054* | |
| C6 | 0.22824 (15) | 0.6994 (2) | 0.1618 (2) | 0.0437 (8) | |
| C7 | 0.32028 (16) | 0.6787 (3) | 0.0335 (2) | 0.0497 (9) | |
| H7 | 0.3143 | 0.6126 | 0.0226 | 0.060* | |
| C8 | 0.36060 (15) | 0.7304 (3) | −0.0009 (2) | 0.0492 (9) | |
| C9 | 0.39393 (18) | 0.6808 (3) | −0.0440 (3) | 0.0629 (11) | |
| H9 | 0.3893 | 0.6137 | −0.0514 | 0.075* | |
| C10 | 0.43334 (18) | 0.7280 (4) | −0.0756 (3) | 0.0657 (11) | |
| H10 | 0.4556 | 0.6936 | −0.1054 | 0.079* | |
| C11 | 0.44089 (18) | 0.8263 (3) | −0.0643 (3) | 0.0610 (11) | |
| C12 | 0.40796 (18) | 0.8751 (3) | −0.0220 (3) | 0.0624 (11) | |
| H12 | 0.4131 | 0.9420 | −0.0139 | 0.075* | |
| C13 | 0.36835 (17) | 0.8298 (3) | 0.0086 (2) | 0.0549 (10) | |
| H13 | 0.3455 | 0.8654 | 0.0367 | 0.066* | |
| C14 | 0.4834 (2) | 0.8750 (4) | −0.0962 (3) | 0.0731 (13) | |
| C15 | 0.18030 (14) | 0.0956 (3) | 0.1923 (2) | 0.0434 (8) | |
| H15 | 0.1556 | 0.0994 | 0.2283 | 0.052* | |
| C16 | 0.19682 (16) | 0.0068 (3) | 0.1717 (2) | 0.0496 (9) | |
| H16 | 0.1842 | −0.0494 | 0.1936 | 0.060* | |
| C17 | 0.23172 (15) | 0.0003 (2) | 0.1192 (2) | 0.0440 (8) | |
| H17 | 0.2436 | −0.0606 | 0.1042 | 0.053* | |
| C18 | 0.24964 (13) | 0.0833 (2) | 0.08797 (19) | 0.0390 (7) | |
| C19 | 0.23178 (14) | 0.1700 (2) | 0.1127 (2) | 0.0408 (7) | |
| H19 | 0.2445 | 0.2273 | 0.0924 | 0.049* | |
| C20 | 0.28677 (14) | 0.0743 (2) | 0.0289 (2) | 0.0421 (8) | |
| C21 | 0.38690 (16) | 0.2191 (3) | −0.0263 (2) | 0.0513 (9) | |
| H21 | 0.3784 | 0.2739 | 0.0016 | 0.062* | |
| C22 | 0.43167 (14) | 0.2241 (3) | −0.0711 (2) | 0.0470 (8) | |
| C23 | 0.45139 (15) | 0.1431 (3) | −0.1041 (2) | 0.0496 (9) | |
| H23 | 0.4343 | 0.0828 | −0.1004 | 0.059* | |
| C24 | 0.49545 (16) | 0.1502 (3) | −0.1419 (2) | 0.0516 (9) | |
| H24 | 0.5091 | 0.0949 | −0.1639 | 0.062* | |
| C25 | 0.52007 (14) | 0.2387 (3) | −0.1478 (2) | 0.0481 (8) | |
| C26 | 0.50079 (18) | 0.3193 (3) | −0.1168 (3) | 0.0615 (11) | |
| H26 | 0.5176 | 0.3796 | −0.1218 | 0.074* | |
| C27 | 0.45664 (18) | 0.3123 (3) | −0.0780 (3) | 0.0590 (11) | |
| H27 | 0.4433 | 0.3678 | −0.0559 | 0.071* | |
| C28 | 0.56767 (15) | 0.2436 (3) | −0.1854 (2) | 0.0524 (9) | |
| C29 | 0.4169 (2) | 0.4087 (4) | 0.1813 (4) | 0.0870 (16) | |
| H28 | 0.3208 (14) | 0.1991 (18) | 0.0520 (17) | 0.034 (9)* | |
| H29 | 0.2522 (16) | 0.6077 (15) | 0.088 (2) | 0.077 (15)* |
| Ag1 | 0.0648 (2) | 0.03572 (18) | 0.0846 (3) | 0.00461 (12) | 0.03151 (17) | −0.00623 (14) |
| N1 | 0.0518 (17) | 0.0365 (16) | 0.0593 (18) | 0.0005 (13) | 0.0199 (14) | −0.0055 (13) |
| N2 | 0.0429 (15) | 0.0342 (15) | 0.0533 (17) | 0.0026 (12) | 0.0204 (13) | 0.0006 (12) |
| N3 | 0.0516 (18) | 0.0351 (17) | 0.062 (2) | −0.0037 (13) | 0.0157 (15) | −0.0009 (14) |
| N4 | 0.0453 (17) | 0.0426 (17) | 0.0613 (19) | −0.0032 (13) | 0.0087 (14) | 0.0035 (15) |
| N5 | 0.097 (3) | 0.080 (3) | 0.145 (5) | 0.001 (3) | 0.067 (3) | 0.018 (3) |
| N6 | 0.0516 (18) | 0.0436 (17) | 0.0556 (18) | −0.0025 (14) | 0.0308 (14) | −0.0074 (15) |
| N7 | 0.0481 (17) | 0.0516 (18) | 0.0530 (17) | 0.0022 (14) | 0.0257 (14) | 0.0003 (15) |
| N8 | 0.055 (2) | 0.083 (3) | 0.067 (2) | −0.0100 (19) | 0.0293 (17) | −0.003 (2) |
| S1 | 0.0696 (6) | 0.0462 (5) | 0.0620 (6) | 0.0057 (5) | 0.0276 (5) | −0.0020 (5) |
| O1 | 0.0777 (19) | 0.0316 (13) | 0.0750 (19) | −0.0016 (13) | 0.0223 (15) | −0.0033 (13) |
| O2 | 0.0707 (18) | 0.0435 (15) | 0.0692 (18) | −0.0031 (13) | 0.0324 (14) | −0.0152 (13) |
| O3 | 0.116 (3) | 0.066 (2) | 0.081 (2) | −0.0313 (19) | 0.039 (2) | −0.0132 (17) |
| O4 | 0.107 (3) | 0.085 (3) | 0.078 (2) | 0.038 (2) | 0.029 (2) | −0.0101 (19) |
| O5 | 0.129 (3) | 0.063 (2) | 0.073 (2) | 0.010 (2) | 0.048 (2) | 0.0106 (17) |
| F1 | 0.107 (3) | 0.242 (6) | 0.198 (5) | 0.086 (3) | 0.042 (3) | 0.023 (4) |
| F2 | 0.105 (2) | 0.118 (3) | 0.094 (2) | −0.018 (2) | 0.0007 (19) | 0.033 (2) |
| F3 | 0.157 (4) | 0.179 (5) | 0.188 (4) | −0.111 (4) | −0.028 (3) | 0.067 (4) |
| C1 | 0.051 (2) | 0.047 (2) | 0.072 (3) | −0.0022 (17) | 0.0272 (19) | −0.0071 (19) |
| C2 | 0.061 (2) | 0.050 (2) | 0.080 (3) | 0.0048 (19) | 0.034 (2) | −0.014 (2) |
| C3 | 0.063 (2) | 0.038 (2) | 0.073 (3) | 0.0095 (17) | 0.024 (2) | −0.0100 (18) |
| C4 | 0.0428 (18) | 0.0347 (18) | 0.0459 (18) | 0.0056 (14) | 0.0082 (14) | −0.0045 (14) |
| C5 | 0.0493 (19) | 0.0372 (18) | 0.052 (2) | 0.0074 (15) | 0.0164 (16) | −0.0047 (15) |
| C6 | 0.0469 (19) | 0.0330 (18) | 0.051 (2) | 0.0038 (14) | 0.0069 (16) | −0.0007 (14) |
| C7 | 0.048 (2) | 0.043 (2) | 0.058 (2) | 0.0004 (16) | 0.0065 (17) | 0.0016 (17) |
| C8 | 0.0431 (19) | 0.053 (2) | 0.051 (2) | −0.0008 (16) | 0.0067 (16) | 0.0048 (17) |
| C9 | 0.060 (3) | 0.059 (3) | 0.073 (3) | −0.001 (2) | 0.020 (2) | −0.010 (2) |
| C10 | 0.061 (3) | 0.072 (3) | 0.069 (3) | 0.004 (2) | 0.027 (2) | −0.005 (2) |
| C11 | 0.052 (2) | 0.067 (3) | 0.065 (3) | 0.0033 (19) | 0.012 (2) | 0.012 (2) |
| C12 | 0.066 (3) | 0.049 (2) | 0.076 (3) | −0.0001 (19) | 0.025 (2) | 0.011 (2) |
| C13 | 0.056 (2) | 0.047 (2) | 0.064 (2) | 0.0069 (17) | 0.0162 (19) | 0.0032 (18) |
| C14 | 0.065 (3) | 0.070 (3) | 0.091 (3) | 0.006 (2) | 0.032 (3) | 0.012 (3) |
| C15 | 0.0481 (19) | 0.0362 (18) | 0.0500 (19) | −0.0016 (14) | 0.0212 (16) | −0.0007 (15) |
| C16 | 0.063 (2) | 0.0335 (18) | 0.057 (2) | −0.0047 (16) | 0.0237 (18) | 0.0053 (16) |
| C17 | 0.054 (2) | 0.0294 (16) | 0.052 (2) | −0.0002 (14) | 0.0169 (16) | −0.0006 (14) |
| C18 | 0.0390 (17) | 0.0349 (17) | 0.0456 (18) | 0.0005 (13) | 0.0141 (14) | −0.0002 (14) |
| C19 | 0.0425 (18) | 0.0305 (17) | 0.053 (2) | −0.0001 (13) | 0.0196 (15) | 0.0028 (14) |
| C20 | 0.0427 (18) | 0.0383 (18) | 0.0485 (19) | 0.0036 (14) | 0.0172 (15) | 0.0025 (15) |
| C21 | 0.054 (2) | 0.050 (2) | 0.056 (2) | −0.0010 (17) | 0.0284 (18) | −0.0037 (18) |
| C22 | 0.0435 (19) | 0.051 (2) | 0.050 (2) | −0.0004 (16) | 0.0188 (16) | 0.0042 (17) |
| C23 | 0.047 (2) | 0.047 (2) | 0.058 (2) | −0.0052 (16) | 0.0204 (17) | 0.0013 (18) |
| C24 | 0.052 (2) | 0.051 (2) | 0.056 (2) | 0.0028 (17) | 0.0228 (17) | 0.0001 (18) |
| C25 | 0.0424 (19) | 0.059 (2) | 0.0463 (19) | −0.0018 (16) | 0.0185 (15) | 0.0042 (17) |
| C26 | 0.059 (2) | 0.057 (3) | 0.076 (3) | −0.0119 (19) | 0.033 (2) | 0.001 (2) |
| C27 | 0.060 (2) | 0.050 (2) | 0.074 (3) | −0.0063 (18) | 0.034 (2) | −0.0062 (19) |
| C28 | 0.047 (2) | 0.065 (3) | 0.048 (2) | −0.0058 (18) | 0.0171 (16) | −0.0006 (18) |
| C29 | 0.071 (3) | 0.080 (4) | 0.115 (4) | −0.009 (3) | 0.032 (3) | 0.026 (3) |
| Ag1—N1 | 2.190 (3) | C7—C8 | 1.444 (5) |
| Ag1—N2 | 2.207 (3) | C7—H7 | 0.9500 |
| Ag1—N8i | 2.518 (3) | C8—C9 | 1.392 (6) |
| N1—C5 | 1.341 (5) | C8—C13 | 1.407 (6) |
| N1—C1 | 1.341 (5) | C9—C10 | 1.370 (6) |
| N2—C19 | 1.340 (4) | C9—H9 | 0.9500 |
| N2—C15 | 1.340 (4) | C10—C11 | 1.396 (7) |
| N3—C6 | 1.348 (5) | C10—H10 | 0.9500 |
| N3—N4 | 1.370 (4) | C11—C12 | 1.372 (6) |
| N3—H29 | 0.869 (14) | C11—C14 | 1.442 (6) |
| N4—C7 | 1.278 (5) | C12—C13 | 1.351 (6) |
| N5—C14 | 1.133 (6) | C12—H12 | 0.9500 |
| N6—C20 | 1.348 (5) | C13—H13 | 0.9500 |
| N6—N7 | 1.383 (4) | C15—C16 | 1.372 (5) |
| N6—H28 | 0.852 (18) | C15—H15 | 0.9500 |
| N7—C21 | 1.270 (5) | C16—C17 | 1.367 (5) |
| N8—C28 | 1.134 (5) | C16—H16 | 0.9500 |
| N8—Ag1ii | 2.518 (3) | C17—C18 | 1.385 (5) |
| S1—O4 | 1.424 (3) | C17—H17 | 0.9500 |
| S1—O5 | 1.430 (3) | C18—C19 | 1.382 (5) |
| S1—O3 | 1.429 (3) | C18—C20 | 1.501 (4) |
| S1—C29 | 1.782 (6) | C19—H19 | 0.9500 |
| O1—C6 | 1.232 (4) | C21—C22 | 1.464 (5) |
| O2—C20 | 1.220 (4) | C21—H21 | 0.9500 |
| F1—C29 | 1.324 (8) | C22—C23 | 1.395 (6) |
| F2—C29 | 1.311 (6) | C22—C27 | 1.392 (5) |
| F3—C29 | 1.292 (7) | C23—C24 | 1.372 (5) |
| C1—C2 | 1.370 (6) | C23—H23 | 0.9500 |
| C1—H1 | 0.9500 | C24—C25 | 1.390 (6) |
| C2—C3 | 1.374 (6) | C24—H24 | 0.9500 |
| C2—H2 | 0.9500 | C25—C26 | 1.369 (6) |
| C3—C4 | 1.383 (5) | C25—C28 | 1.446 (5) |
| C3—H3 | 0.9500 | C26—C27 | 1.385 (6) |
| C4—C5 | 1.382 (5) | C26—H26 | 0.9500 |
| C4—C6 | 1.478 (5) | C27—H27 | 0.9500 |
| C5—H5 | 0.9500 | ||
| N1—Ag1—N2 | 158.96 (11) | C12—C11—C14 | 121.0 (4) |
| N1—Ag1—N8i | 100.66 (12) | C10—C11—C14 | 119.9 (4) |
| N2—Ag1—N8i | 96.76 (12) | C13—C12—C11 | 121.3 (4) |
| C5—N1—C1 | 117.6 (3) | C13—C12—H12 | 119.4 |
| C5—N1—Ag1 | 120.3 (2) | C11—C12—H12 | 119.4 |
| C1—N1—Ag1 | 122.1 (3) | C12—C13—C8 | 120.6 (4) |
| C19—N2—C15 | 117.4 (3) | C12—C13—H13 | 119.7 |
| C19—N2—Ag1 | 122.3 (2) | C8—C13—H13 | 119.7 |
| C15—N2—Ag1 | 119.8 (2) | N5—C14—C11 | 179.1 (6) |
| C6—N3—N4 | 120.0 (3) | N2—C15—C16 | 122.9 (3) |
| C6—N3—H29 | 125.3 (15) | N2—C15—H15 | 118.5 |
| N4—N3—H29 | 114.6 (15) | C16—C15—H15 | 118.5 |
| C7—N4—N3 | 114.7 (3) | C17—C16—C15 | 119.2 (3) |
| C20—N6—N7 | 119.3 (3) | C17—C16—H16 | 120.4 |
| C20—N6—H28 | 124 (2) | C15—C16—H16 | 120.4 |
| N7—N6—H28 | 117 (2) | C16—C17—C18 | 119.4 (3) |
| C21—N7—N6 | 114.0 (3) | C16—C17—H17 | 120.3 |
| C28—N8—Ag1ii | 158.1 (4) | C18—C17—H17 | 120.3 |
| O4—S1—O5 | 115.5 (2) | C19—C18—C17 | 117.8 (3) |
| O4—S1—O3 | 115.0 (2) | C19—C18—C20 | 123.7 (3) |
| O5—S1—O3 | 114.8 (2) | C17—C18—C20 | 118.5 (3) |
| O4—S1—C29 | 102.4 (3) | N2—C19—C18 | 123.3 (3) |
| O5—S1—C29 | 104.0 (3) | N2—C19—H19 | 118.3 |
| O3—S1—C29 | 102.7 (3) | C18—C19—H19 | 118.3 |
| N1—C1—C2 | 122.8 (4) | O2—C20—N6 | 124.0 (3) |
| N1—C1—H1 | 118.6 | O2—C20—C18 | 120.5 (3) |
| C2—C1—H1 | 118.6 | N6—C20—C18 | 115.5 (3) |
| C1—C2—C3 | 118.7 (4) | N7—C21—C22 | 121.4 (4) |
| C1—C2—H2 | 120.6 | N7—C21—H21 | 119.3 |
| C3—C2—H2 | 120.6 | C22—C21—H21 | 119.3 |
| C2—C3—C4 | 120.1 (3) | C23—C22—C27 | 119.3 (3) |
| C2—C3—H3 | 119.9 | C23—C22—C21 | 122.2 (4) |
| C4—C3—H3 | 119.9 | C27—C22—C21 | 118.4 (4) |
| C3—C4—C5 | 117.1 (3) | C24—C23—C22 | 120.2 (4) |
| C3—C4—C6 | 118.2 (3) | C24—C23—H23 | 119.9 |
| C5—C4—C6 | 124.6 (3) | C22—C23—H23 | 119.9 |
| N1—C5—C4 | 123.6 (3) | C23—C24—C25 | 119.7 (4) |
| N1—C5—H5 | 118.2 | C23—C24—H24 | 120.1 |
| C4—C5—H5 | 118.2 | C25—C24—H24 | 120.1 |
| O1—C6—N3 | 123.1 (4) | C26—C25—C24 | 120.9 (3) |
| O1—C6—C4 | 120.8 (3) | C26—C25—C28 | 120.5 (4) |
| N3—C6—C4 | 116.1 (3) | C24—C25—C28 | 118.6 (4) |
| N4—C7—C8 | 120.3 (4) | C25—C26—C27 | 119.5 (4) |
| N4—C7—H7 | 119.9 | C25—C26—H26 | 120.2 |
| C8—C7—H7 | 119.9 | C27—C26—H26 | 120.2 |
| C9—C8—C13 | 118.2 (4) | C26—C27—C22 | 120.3 (4) |
| C9—C8—C7 | 119.5 (4) | C26—C27—H27 | 119.8 |
| C13—C8—C7 | 122.3 (4) | C22—C27—H27 | 119.8 |
| C10—C9—C8 | 120.5 (4) | N8—C28—C25 | 178.6 (5) |
| C10—C9—H9 | 119.7 | F3—C29—F2 | 105.7 (6) |
| C8—C9—H9 | 119.7 | F3—C29—F1 | 107.3 (6) |
| C9—C10—C11 | 120.2 (4) | F2—C29—F1 | 105.2 (5) |
| C9—C10—H10 | 119.9 | F3—C29—S1 | 113.3 (4) |
| C11—C10—H10 | 119.9 | F2—C29—S1 | 114.0 (4) |
| C12—C11—C10 | 119.1 (4) | F1—C29—S1 | 110.8 (5) |
| N2—Ag1—N1—C5 | −34.0 (5) | C19—N2—C15—C16 | 0.6 (5) |
| N8i—Ag1—N1—C5 | −179.4 (3) | Ag1—N2—C15—C16 | −171.5 (3) |
| N2—Ag1—N1—C1 | 149.7 (3) | N2—C15—C16—C17 | −0.9 (6) |
| N8i—Ag1—N1—C1 | 4.4 (3) | C15—C16—C17—C18 | 0.0 (6) |
| N1—Ag1—N2—C19 | 27.7 (5) | C16—C17—C18—C19 | 1.0 (5) |
| N8i—Ag1—N2—C19 | 173.4 (3) | C16—C17—C18—C20 | −178.4 (3) |
| N1—Ag1—N2—C15 | −160.7 (3) | C15—N2—C19—C18 | 0.6 (5) |
| N8i—Ag1—N2—C15 | −14.9 (3) | Ag1—N2—C19—C18 | 172.4 (3) |
| C6—N3—N4—C7 | 174.1 (3) | C17—C18—C19—N2 | −1.4 (5) |
| C20—N6—N7—C21 | 177.1 (4) | C20—C18—C19—N2 | 178.0 (3) |
| C5—N1—C1—C2 | −0.9 (6) | N7—N6—C20—O2 | −4.8 (6) |
| Ag1—N1—C1—C2 | 175.5 (3) | N7—N6—C20—C18 | 174.3 (3) |
| N1—C1—C2—C3 | 0.1 (7) | C19—C18—C20—O2 | −153.1 (4) |
| C1—C2—C3—C4 | 1.0 (7) | C17—C18—C20—O2 | 26.3 (5) |
| C2—C3—C4—C5 | −1.2 (6) | C19—C18—C20—N6 | 27.7 (5) |
| C2—C3—C4—C6 | −178.1 (4) | C17—C18—C20—N6 | −152.9 (3) |
| C1—N1—C5—C4 | 0.6 (6) | N6—N7—C21—C22 | 176.8 (3) |
| Ag1—N1—C5—C4 | −175.8 (3) | N7—C21—C22—C23 | −9.6 (6) |
| C3—C4—C5—N1 | 0.4 (6) | N7—C21—C22—C27 | 173.2 (4) |
| C6—C4—C5—N1 | 177.1 (3) | C27—C22—C23—C24 | 1.0 (6) |
| N4—N3—C6—O1 | 2.4 (6) | C21—C22—C23—C24 | −176.2 (4) |
| N4—N3—C6—C4 | −176.0 (3) | C22—C23—C24—C25 | −0.6 (6) |
| C3—C4—C6—O1 | 14.1 (5) | C23—C24—C25—C26 | −0.4 (6) |
| C5—C4—C6—O1 | −162.6 (4) | C23—C24—C25—C28 | 177.7 (4) |
| C3—C4—C6—N3 | −167.4 (4) | C24—C25—C26—C27 | 1.0 (7) |
| C5—C4—C6—N3 | 15.9 (5) | C28—C25—C26—C27 | −177.0 (4) |
| N3—N4—C7—C8 | −179.1 (3) | C25—C26—C27—C22 | −0.6 (7) |
| N4—C7—C8—C9 | 173.9 (4) | C23—C22—C27—C26 | −0.4 (7) |
| N4—C7—C8—C13 | −4.9 (6) | C21—C22—C27—C26 | 176.9 (4) |
| C13—C8—C9—C10 | 0.4 (6) | O4—S1—C29—F3 | −62.1 (6) |
| C7—C8—C9—C10 | −178.4 (4) | O5—S1—C29—F3 | 58.4 (6) |
| C8—C9—C10—C11 | 0.7 (7) | O3—S1—C29—F3 | 178.4 (5) |
| C9—C10—C11—C12 | −0.8 (7) | O4—S1—C29—F2 | 58.8 (5) |
| C9—C10—C11—C14 | 178.4 (4) | O5—S1—C29—F2 | 179.4 (4) |
| C10—C11—C12—C13 | −0.3 (7) | O3—S1—C29—F2 | −60.7 (5) |
| C14—C11—C12—C13 | −179.4 (4) | O4—S1—C29—F1 | 177.3 (4) |
| C11—C12—C13—C8 | 1.5 (7) | O5—S1—C29—F1 | −62.2 (5) |
| C9—C8—C13—C12 | −1.5 (6) | O3—S1—C29—F1 | 57.8 (5) |
| C7—C8—C13—C12 | 177.3 (4) |
| H··· | ||||
| N3—H29···O2iii | 0.87 (1) | 2.18 (2) | 2.999 (4) | 156 (4) |
| N6—H28···O3 | 0.85 (2) | 2.07 (2) | 2.911 (5) | 171 (3) |
| Ag1—N1 | 2.190 (3) |
| Ag1—N2 | 2.207 (3) |
| Ag1—N8i | 2.518 (3) |
| N1—Ag1—N2 | 158.96 (11) |
| N1—Ag1—N8i | 100.66 (12) |
| N2—Ag1—N8i | 96.76 (12) |
Symmetry code: (i) .
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| N3—H29⋯O2ii | 0.869 (14) | 2.18 (2) | 2.999 (4) | 156 (4) |
| N6—H28⋯O3 | 0.852 (18) | 2.07 (2) | 2.911 (5) | 171 (3) |
Symmetry code: (ii) .