| Literature DB >> 21579929 |
Shuang Han, Wan-Cheng Li, Dao-Cheng Xia.
Abstract
The asymmetric unit of the title compound, [Ag(C(9)H(8)N(2))(2)]NO(3), contains one complete [Ag(C(9)H(8)N(2))(2)](+) cation and two half-cations (with the other halves generated through inversion) and two NO(3) (-) anions. Each Ag(I) ion shows a linear AgN(2) coordination. The ions are linked by N-H⋯O hydrogen bonds.Entities:
Year: 2009 PMID: 21579929 PMCID: PMC2980267 DOI: 10.1107/S1600536809051459
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ag(C9H8N2)2]NO3 | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 8475 reflections | |
| θ = 3.0–29.1° | |
| µ = 1.11 mm−1 | |
| α = 88.307 (5)° | |
| β = 80.976 (5)° | Block, colourless |
| γ = 72.369 (5)° | 0.31 × 0.28 × 0.22 mm |
| Oxford Diffraction Gemini R Ultra diffractometer | 8475 independent reflections |
| Radiation source: fine-focus sealed tube | 4372 reflections with |
| graphite | |
| Detector resolution: 10.0 pixels mm-1 | θmax = 29.1°, θmin = 1.8° |
| ω scan | |
| Absorption correction: multi-scan (CrysAlis; Oxford Diffraction, 2006) | |
| 14127 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 | |
| 8475 reflections | (Δ/σ)max = 0.002 |
| 490 parameters | Δρmax = 0.28 e Å−3 |
| 0 restraints | Δρmin = −0.43 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 |
| C1 | 0.2039 (4) | 0.7556 (4) | 0.48467 (13) | 0.0638 (9) | |
| H1 | 0.2611 | 0.8103 | 0.4622 | 0.077* | |
| C2 | 0.0492 (4) | 0.7985 (3) | 0.49731 (12) | 0.0594 (8) | |
| H2A | −0.0197 | 0.8856 | 0.4853 | 0.071* | |
| C3 | 0.1453 (3) | 0.5807 (3) | 0.53886 (11) | 0.0468 (7) | |
| C4 | 0.1492 (3) | 0.4477 (3) | 0.57426 (12) | 0.0519 (7) | |
| C5 | 0.2697 (4) | 0.3145 (4) | 0.56355 (15) | 0.0728 (10) | |
| H5 | 0.3513 | 0.3085 | 0.5335 | 0.087* | |
| C6 | 0.2676 (6) | 0.1892 (4) | 0.5984 (2) | 0.1029 (15) | |
| H6A | 0.3488 | 0.1000 | 0.5917 | 0.123* | |
| C7 | 0.1483 (7) | 0.1965 (5) | 0.6419 (2) | 0.1033 (16) | |
| H7A | 0.1477 | 0.1117 | 0.6643 | 0.124* | |
| C8 | 0.0300 (5) | 0.3259 (5) | 0.65292 (16) | 0.0858 (12) | |
| H8 | −0.0514 | 0.3298 | 0.6828 | 0.103* | |
| C9 | 0.0301 (4) | 0.4525 (4) | 0.61976 (13) | 0.0642 (9) | |
| H9 | −0.0504 | 0.5417 | 0.6281 | 0.077* | |
| C10 | 0.5291 (4) | 0.3440 (4) | 0.68802 (15) | 0.0770 (10) | |
| H10 | 0.5854 | 0.2473 | 0.6976 | 0.092* | |
| C11 | 0.5840 (4) | 0.4361 (4) | 0.65051 (14) | 0.0703 (9) | |
| H11 | 0.6833 | 0.4156 | 0.6297 | 0.084* | |
| C12 | 0.3411 (3) | 0.5502 (4) | 0.68619 (11) | 0.0531 (8) | |
| C13 | 0.1928 (3) | 0.6666 (4) | 0.69513 (12) | 0.0535 (8) | |
| C14 | 0.0864 (4) | 0.6708 (4) | 0.74507 (13) | 0.0675 (9) | |
| H14 | 0.1112 | 0.5999 | 0.7741 | 0.081* | |
| C15 | −0.0549 (4) | 0.7784 (5) | 0.75202 (16) | 0.0831 (11) | |
| H15 | −0.1255 | 0.7793 | 0.7856 | 0.100* | |
| C16 | −0.0939 (4) | 0.8843 (5) | 0.71036 (19) | 0.0888 (11) | |
| H16 | −0.1902 | 0.9570 | 0.7156 | 0.107* | |
| C17 | 0.0100 (4) | 0.8830 (4) | 0.66062 (16) | 0.0768 (10) | |
| H17 | −0.0162 | 0.9550 | 0.6321 | 0.092* | |
| C18 | 0.1526 (4) | 0.7756 (4) | 0.65282 (13) | 0.0629 (8) | |
| H18 | 0.2225 | 0.7756 | 0.6191 | 0.076* | |
| C19 | −0.0449 (4) | 0.2333 (4) | 0.83247 (15) | 0.0759 (10) | |
| H19 | −0.1031 | 0.3343 | 0.8314 | 0.091* | |
| C20 | −0.0945 (4) | 0.1228 (4) | 0.86113 (13) | 0.0665 (9) | |
| H20 | −0.1908 | 0.1336 | 0.8832 | 0.080* | |
| C21 | 0.1440 (3) | 0.0264 (4) | 0.81694 (11) | 0.0513 (7) | |
| C22 | 0.2921 (3) | −0.0865 (4) | 0.79868 (11) | 0.0513 (7) | |
| C23 | 0.3918 (4) | −0.0679 (4) | 0.74913 (12) | 0.0705 (9) | |
| H23 | 0.3614 | 0.0170 | 0.7263 | 0.085* | |
| C24 | 0.5334 (4) | −0.1714 (5) | 0.73331 (16) | 0.0876 (12) | |
| H24 | 0.5984 | −0.1561 | 0.7003 | 0.105* | |
| C25 | 0.5795 (4) | −0.2975 (5) | 0.76602 (19) | 0.0915 (12) | |
| H25 | 0.6758 | −0.3679 | 0.7552 | 0.110* | |
| C26 | 0.4839 (4) | −0.3200 (4) | 0.81467 (17) | 0.0835 (11) | |
| H26 | 0.5155 | −0.4061 | 0.8368 | 0.100* | |
| C27 | 0.3413 (4) | −0.2161 (4) | 0.83117 (14) | 0.0657 (9) | |
| H27 | 0.2772 | −0.2327 | 0.8643 | 0.079* | |
| C28 | 0.3155 (4) | 0.3721 (4) | 0.88477 (16) | 0.0765 (10) | |
| H28 | 0.3069 | 0.4670 | 0.8689 | 0.092* | |
| C29 | 0.4421 (4) | 0.2525 (4) | 0.86556 (14) | 0.0686 (9) | |
| H29 | 0.5199 | 0.2668 | 0.8372 | 0.082* | |
| C30 | 0.4548 (3) | 0.1094 (3) | 0.88841 (12) | 0.0566 (8) | |
| H30 | 0.5404 | 0.0278 | 0.8751 | 0.068* | |
| C31 | 0.3391 (3) | 0.0887 (3) | 0.93131 (11) | 0.0431 (7) | |
| C32 | 0.2134 (3) | 0.2126 (3) | 0.94971 (12) | 0.0564 (8) | |
| H32 | 0.1349 | 0.2003 | 0.9782 | 0.068* | |
| C33 | 0.2016 (4) | 0.3536 (4) | 0.92696 (15) | 0.0708 (9) | |
| H33 | 0.1166 | 0.4358 | 0.9402 | 0.085* | |
| C34 | 0.3518 (3) | −0.0615 (3) | 0.95527 (11) | 0.0417 (6) | |
| C35 | 0.4571 (3) | −0.2971 (3) | 0.97852 (14) | 0.0644 (9) | |
| H35 | 0.5294 | −0.3899 | 0.9831 | 0.077* | |
| C36 | 0.3034 (3) | −0.2594 (3) | 0.99545 (13) | 0.0617 (8) | |
| H36 | 0.2506 | −0.3234 | 1.0139 | 0.074* | |
| O1 | 0.2835 (2) | 0.3113 (3) | 0.41706 (10) | 0.0778 (7) | |
| O2 | 0.5143 (3) | 0.1699 (3) | 0.41170 (11) | 0.0944 (8) | |
| O3 | 0.3276 (3) | 0.0750 (3) | 0.43228 (14) | 0.1103 (10) | |
| O4 | 0.1720 (3) | 0.3963 (3) | 1.08721 (12) | 0.0926 (8) | |
| O5 | 0.2200 (2) | 0.1559 (2) | 1.09430 (9) | 0.0675 (6) | |
| O6 | −0.0137 (2) | 0.2969 (3) | 1.10375 (11) | 0.0854 (8) | |
| Ag1 | 0.0000 | 0.0000 | 1.0000 | 0.05936 (11) | |
| Ag2 | 0.23738 (3) | 0.30005 (3) | 0.759780 (12) | 0.08314 (12) | |
| Ag3 | 0.5000 | 0.5000 | 0.5000 | 0.07317 (13) | |
| N1 | 0.1033 (3) | 0.1731 (3) | 0.80549 (10) | 0.0642 (7) | |
| N2 | 0.0241 (3) | −0.0054 (3) | 0.85106 (10) | 0.0574 (7) | |
| H2 | 0.0239 | −0.0931 | 0.8641 | 0.069* | |
| N3 | 0.4853 (2) | −0.1724 (2) | 0.95343 (9) | 0.0512 (6) | |
| H3 | 0.5747 | −0.1656 | 0.9387 | 0.061* | |
| N4 | 0.2370 (2) | −0.1122 (3) | 0.98131 (10) | 0.0518 (6) | |
| N5 | 0.3783 (3) | 0.4142 (3) | 0.70973 (11) | 0.0650 (7) | |
| N6 | 0.4661 (3) | 0.5638 (3) | 0.64922 (10) | 0.0579 (7) | |
| H6 | 0.4693 | 0.6415 | 0.6284 | 0.069* | |
| N7 | 0.0144 (3) | 0.6876 (3) | 0.53138 (10) | 0.0513 (6) | |
| H7 | −0.0771 | 0.6863 | 0.5458 | 0.062* | |
| N8 | 0.2649 (2) | 0.6190 (3) | 0.50983 (10) | 0.0574 (6) | |
| N9 | 0.3743 (3) | 0.1830 (3) | 0.42040 (11) | 0.0659 (7) | |
| N10 | 0.1257 (3) | 0.2861 (3) | 1.09532 (10) | 0.0595 (7) |
| C1 | 0.058 (2) | 0.064 (2) | 0.069 (2) | −0.0259 (18) | 0.0022 (16) | 0.0091 (17) |
| C2 | 0.059 (2) | 0.045 (2) | 0.074 (2) | −0.0155 (16) | −0.0115 (15) | 0.0133 (16) |
| C3 | 0.0399 (17) | 0.0372 (18) | 0.0618 (17) | −0.0096 (14) | −0.0072 (13) | −0.0040 (14) |
| C4 | 0.0543 (19) | 0.040 (2) | 0.0655 (18) | −0.0133 (16) | −0.0252 (15) | 0.0029 (15) |
| C5 | 0.071 (2) | 0.052 (2) | 0.093 (2) | −0.004 (2) | −0.0319 (18) | −0.0003 (19) |
| C6 | 0.116 (4) | 0.042 (3) | 0.156 (4) | −0.002 (2) | −0.082 (3) | 0.006 (3) |
| C7 | 0.134 (4) | 0.079 (4) | 0.135 (4) | −0.059 (3) | −0.091 (3) | 0.049 (3) |
| C8 | 0.094 (3) | 0.088 (3) | 0.099 (3) | −0.050 (3) | −0.047 (2) | 0.043 (2) |
| C9 | 0.058 (2) | 0.057 (2) | 0.085 (2) | −0.0246 (17) | −0.0236 (17) | 0.0221 (17) |
| C10 | 0.071 (2) | 0.058 (2) | 0.097 (3) | −0.016 (2) | −0.011 (2) | 0.019 (2) |
| C11 | 0.056 (2) | 0.064 (3) | 0.088 (2) | −0.021 (2) | 0.0027 (17) | 0.0080 (19) |
| C12 | 0.059 (2) | 0.058 (2) | 0.0521 (17) | −0.0357 (17) | −0.0021 (14) | 0.0015 (15) |
| C13 | 0.056 (2) | 0.059 (2) | 0.0558 (18) | −0.0344 (17) | −0.0035 (14) | −0.0080 (15) |
| C14 | 0.064 (2) | 0.081 (3) | 0.065 (2) | −0.035 (2) | −0.0042 (16) | −0.0037 (17) |
| C15 | 0.060 (2) | 0.107 (3) | 0.083 (3) | −0.034 (2) | 0.0069 (19) | −0.016 (2) |
| C16 | 0.055 (2) | 0.086 (3) | 0.123 (3) | −0.018 (2) | −0.010 (2) | −0.016 (3) |
| C17 | 0.069 (3) | 0.072 (3) | 0.094 (3) | −0.025 (2) | −0.020 (2) | 0.008 (2) |
| C18 | 0.068 (2) | 0.064 (2) | 0.064 (2) | −0.0339 (19) | −0.0061 (16) | 0.0019 (17) |
| C19 | 0.066 (2) | 0.055 (2) | 0.101 (3) | −0.0134 (19) | −0.0087 (19) | 0.0177 (19) |
| C20 | 0.050 (2) | 0.062 (2) | 0.083 (2) | −0.0173 (18) | 0.0016 (16) | 0.0118 (18) |
| C21 | 0.057 (2) | 0.059 (2) | 0.0456 (16) | −0.0307 (17) | −0.0069 (13) | 0.0079 (14) |
| C22 | 0.0530 (19) | 0.058 (2) | 0.0516 (17) | −0.0299 (17) | −0.0055 (14) | −0.0022 (15) |
| C23 | 0.066 (2) | 0.095 (3) | 0.0609 (19) | −0.044 (2) | −0.0032 (16) | 0.0005 (18) |
| C24 | 0.065 (3) | 0.125 (4) | 0.078 (2) | −0.046 (3) | 0.0149 (19) | −0.022 (2) |
| C25 | 0.056 (2) | 0.107 (4) | 0.110 (3) | −0.027 (2) | 0.005 (2) | −0.035 (3) |
| C26 | 0.063 (3) | 0.069 (3) | 0.120 (3) | −0.022 (2) | −0.010 (2) | −0.009 (2) |
| C27 | 0.056 (2) | 0.063 (2) | 0.081 (2) | −0.0279 (18) | −0.0015 (17) | −0.0055 (19) |
| C28 | 0.076 (3) | 0.047 (2) | 0.109 (3) | −0.017 (2) | −0.031 (2) | 0.032 (2) |
| C29 | 0.059 (2) | 0.071 (3) | 0.082 (2) | −0.030 (2) | −0.0148 (17) | 0.0322 (19) |
| C30 | 0.0407 (17) | 0.049 (2) | 0.077 (2) | −0.0118 (14) | −0.0063 (14) | 0.0159 (16) |
| C31 | 0.0390 (16) | 0.0395 (18) | 0.0511 (15) | −0.0099 (14) | −0.0129 (12) | 0.0071 (13) |
| C32 | 0.0510 (19) | 0.045 (2) | 0.0669 (19) | −0.0067 (16) | −0.0083 (14) | 0.0102 (15) |
| C33 | 0.065 (2) | 0.041 (2) | 0.100 (3) | −0.0046 (17) | −0.0170 (19) | 0.0077 (18) |
| C34 | 0.0305 (15) | 0.0371 (18) | 0.0542 (16) | −0.0063 (13) | −0.0048 (12) | 0.0033 (13) |
| C35 | 0.0461 (19) | 0.0358 (19) | 0.103 (2) | −0.0060 (14) | −0.0025 (16) | 0.0210 (17) |
| C36 | 0.0428 (18) | 0.046 (2) | 0.091 (2) | −0.0145 (15) | 0.0043 (15) | 0.0176 (17) |
| O1 | 0.0471 (13) | 0.0577 (16) | 0.1129 (17) | −0.0039 (12) | 0.0063 (12) | 0.0224 (13) |
| O2 | 0.0428 (14) | 0.0719 (18) | 0.153 (2) | −0.0084 (12) | 0.0064 (13) | 0.0407 (15) |
| O3 | 0.0750 (18) | 0.0600 (18) | 0.187 (3) | −0.0273 (14) | 0.0146 (17) | 0.0236 (17) |
| O4 | 0.0644 (16) | 0.0526 (16) | 0.157 (2) | −0.0223 (13) | 0.0026 (15) | 0.0102 (15) |
| O5 | 0.0415 (12) | 0.0481 (15) | 0.0978 (15) | −0.0010 (11) | 0.0055 (10) | 0.0192 (12) |
| O6 | 0.0352 (13) | 0.0696 (17) | 0.137 (2) | −0.0074 (11) | 0.0056 (12) | 0.0374 (14) |
| Ag1 | 0.03255 (18) | 0.0589 (2) | 0.0786 (2) | −0.00828 (15) | 0.00271 (14) | 0.00923 (17) |
| Ag2 | 0.0825 (2) | 0.0775 (2) | 0.1007 (2) | −0.04617 (16) | −0.00935 (15) | 0.03293 (16) |
| Ag3 | 0.0386 (2) | 0.0909 (3) | 0.0795 (2) | −0.00848 (19) | 0.00153 (16) | −0.0079 (2) |
| N1 | 0.0682 (18) | 0.059 (2) | 0.0698 (16) | −0.0283 (15) | −0.0077 (13) | 0.0195 (14) |
| N2 | 0.0552 (16) | 0.0504 (18) | 0.0674 (15) | −0.0230 (14) | 0.0002 (12) | 0.0116 (13) |
| N3 | 0.0310 (13) | 0.0396 (15) | 0.0779 (16) | −0.0079 (11) | −0.0003 (11) | 0.0112 (12) |
| N4 | 0.0344 (13) | 0.0409 (16) | 0.0744 (15) | −0.0085 (11) | 0.0008 (11) | 0.0086 (12) |
| N5 | 0.0680 (19) | 0.0603 (19) | 0.0721 (17) | −0.0312 (15) | −0.0063 (13) | 0.0172 (14) |
| N6 | 0.0583 (16) | 0.0553 (18) | 0.0618 (15) | −0.0250 (15) | 0.0004 (12) | 0.0073 (12) |
| N7 | 0.0363 (13) | 0.0416 (15) | 0.0731 (15) | −0.0106 (12) | −0.0039 (11) | 0.0087 (12) |
| N8 | 0.0415 (14) | 0.0541 (18) | 0.0722 (16) | −0.0119 (12) | −0.0005 (12) | −0.0007 (13) |
| N9 | 0.0483 (17) | 0.060 (2) | 0.0818 (18) | −0.0153 (16) | 0.0076 (13) | 0.0171 (15) |
| N10 | 0.0461 (17) | 0.053 (2) | 0.0703 (16) | −0.0096 (15) | 0.0040 (12) | 0.0136 (13) |
| C1—C2 | 1.344 (4) | C22—C27 | 1.392 (4) |
| C1—N8 | 1.374 (4) | C22—C23 | 1.393 (4) |
| C1—H1 | 0.93 | C23—C24 | 1.367 (5) |
| C2—N7 | 1.362 (3) | C23—H23 | 0.93 |
| C2—H2A | 0.93 | C24—C25 | 1.367 (5) |
| C3—N8 | 1.335 (3) | C24—H24 | 0.93 |
| C3—N7 | 1.340 (3) | C25—C26 | 1.368 (5) |
| C3—C4 | 1.455 (4) | C25—H25 | 0.93 |
| C4—C5 | 1.386 (4) | C26—C27 | 1.377 (4) |
| C4—C9 | 1.387 (4) | C26—H26 | 0.93 |
| C5—C6 | 1.398 (5) | C27—H27 | 0.93 |
| C5—H5 | 0.93 | C28—C33 | 1.363 (4) |
| C6—C7 | 1.355 (6) | C28—C29 | 1.368 (4) |
| C6—H6A | 0.93 | C28—H28 | 0.93 |
| C7—C8 | 1.353 (6) | C29—C30 | 1.393 (4) |
| C7—H7A | 0.93 | C29—H29 | 0.93 |
| C8—C9 | 1.384 (4) | C30—C31 | 1.392 (3) |
| C8—H8 | 0.93 | C30—H30 | 0.93 |
| C9—H9 | 0.93 | C31—C32 | 1.382 (4) |
| C10—C11 | 1.349 (4) | C31—C34 | 1.462 (4) |
| C10—N5 | 1.363 (4) | C32—C33 | 1.375 (4) |
| C10—H10 | 0.93 | C32—H32 | 0.93 |
| C11—N6 | 1.346 (4) | C33—H33 | 0.93 |
| C11—H11 | 0.93 | C34—N4 | 1.337 (3) |
| C12—N5 | 1.326 (4) | C34—N3 | 1.339 (3) |
| C12—N6 | 1.359 (3) | C35—C36 | 1.347 (4) |
| C12—C13 | 1.451 (4) | C35—N3 | 1.355 (3) |
| C13—C14 | 1.386 (4) | C35—H35 | 0.93 |
| C13—C18 | 1.395 (4) | C36—N4 | 1.369 (4) |
| C14—C15 | 1.368 (5) | C36—H36 | 0.93 |
| C14—H14 | 0.93 | O1—N9 | 1.238 (3) |
| C15—C16 | 1.365 (5) | O2—N9 | 1.241 (3) |
| C15—H15 | 0.93 | O3—N9 | 1.214 (3) |
| C16—C17 | 1.374 (5) | O4—N10 | 1.220 (3) |
| C16—H16 | 0.93 | O5—N10 | 1.254 (3) |
| C17—C18 | 1.376 (4) | O6—N10 | 1.241 (3) |
| C17—H17 | 0.93 | Ag1—N4i | 2.095 (2) |
| C18—H18 | 0.93 | Ag1—N4 | 2.095 (2) |
| C19—C20 | 1.359 (4) | Ag2—N1 | 2.104 (2) |
| C19—N1 | 1.362 (4) | Ag2—N5 | 2.106 (2) |
| C19—H19 | 0.93 | Ag3—N8ii | 2.090 (2) |
| C20—N2 | 1.346 (4) | Ag3—N8 | 2.090 (2) |
| C20—H20 | 0.93 | N2—H2 | 0.86 |
| C21—N1 | 1.328 (4) | N3—H3 | 0.86 |
| C21—N2 | 1.356 (3) | N6—H6 | 0.86 |
| C21—C22 | 1.455 (4) | N7—H7 | 0.86 |
| C2—C1—N8 | 109.9 (3) | C23—C24—H24 | 120.0 |
| C2—C1—H1 | 125.1 | C24—C25—C26 | 120.0 (4) |
| N8—C1—H1 | 125.1 | C24—C25—H25 | 120.0 |
| C1—C2—N7 | 105.6 (3) | C26—C25—H25 | 120.0 |
| C1—C2—H2A | 127.2 | C25—C26—C27 | 120.5 (4) |
| N7—C2—H2A | 127.2 | C25—C26—H26 | 119.8 |
| N8—C3—N7 | 109.0 (2) | C27—C26—H26 | 119.8 |
| N8—C3—C4 | 127.6 (3) | C26—C27—C22 | 120.6 (3) |
| N7—C3—C4 | 123.4 (2) | C26—C27—H27 | 119.7 |
| C5—C4—C9 | 118.6 (3) | C22—C27—H27 | 119.7 |
| C5—C4—C3 | 121.5 (3) | C33—C28—C29 | 120.7 (3) |
| C9—C4—C3 | 119.9 (3) | C33—C28—H28 | 119.6 |
| C4—C5—C6 | 119.4 (4) | C29—C28—H28 | 119.6 |
| C4—C5—H5 | 120.3 | C28—C29—C30 | 120.0 (3) |
| C6—C5—H5 | 120.3 | C28—C29—H29 | 120.0 |
| C7—C6—C5 | 120.7 (4) | C30—C29—H29 | 120.0 |
| C7—C6—H6A | 119.7 | C31—C30—C29 | 119.8 (3) |
| C5—C6—H6A | 119.7 | C31—C30—H30 | 120.1 |
| C8—C7—C6 | 120.6 (4) | C29—C30—H30 | 120.1 |
| C8—C7—H7A | 119.7 | C32—C31—C30 | 118.3 (3) |
| C6—C7—H7A | 119.7 | C32—C31—C34 | 121.7 (2) |
| C7—C8—C9 | 120.1 (4) | C30—C31—C34 | 120.0 (2) |
| C7—C8—H8 | 120.0 | C33—C32—C31 | 121.6 (3) |
| C9—C8—H8 | 120.0 | C33—C32—H32 | 119.2 |
| C8—C9—C4 | 120.7 (3) | C31—C32—H32 | 119.2 |
| C8—C9—H9 | 119.7 | C28—C33—C32 | 119.5 (3) |
| C4—C9—H9 | 119.7 | C28—C33—H33 | 120.2 |
| C11—C10—N5 | 109.6 (3) | C32—C33—H33 | 120.2 |
| C11—C10—H10 | 125.2 | N4—C34—N3 | 109.0 (2) |
| N5—C10—H10 | 125.2 | N4—C34—C31 | 127.2 (2) |
| N6—C11—C10 | 106.1 (3) | N3—C34—C31 | 123.8 (2) |
| N6—C11—H11 | 127.0 | C36—C35—N3 | 106.1 (2) |
| C10—C11—H11 | 127.0 | C36—C35—H35 | 126.9 |
| N5—C12—N6 | 108.5 (3) | N3—C35—H35 | 126.9 |
| N5—C12—C13 | 127.8 (3) | C35—C36—N4 | 109.4 (2) |
| N6—C12—C13 | 123.7 (3) | C35—C36—H36 | 125.3 |
| C14—C13—C18 | 118.3 (3) | N4—C36—H36 | 125.3 |
| C14—C13—C12 | 121.2 (3) | N4i—Ag1—N4 | 180 |
| C18—C13—C12 | 120.5 (3) | N1—Ag2—N5 | 175.94 (11) |
| C15—C14—C13 | 120.5 (3) | N8ii—Ag3—N8 | 180 |
| C15—C14—H14 | 119.8 | C21—N1—C19 | 106.7 (2) |
| C13—C14—H14 | 119.8 | C21—N1—Ag2 | 128.9 (2) |
| C16—C15—C14 | 121.0 (3) | C19—N1—Ag2 | 124.3 (2) |
| C16—C15—H15 | 119.5 | C20—N2—C21 | 108.8 (3) |
| C14—C15—H15 | 119.5 | C20—N2—H2 | 125.6 |
| C15—C16—C17 | 119.6 (4) | C21—N2—H2 | 125.6 |
| C15—C16—H16 | 120.2 | C34—N3—C35 | 109.1 (2) |
| C17—C16—H16 | 120.2 | C34—N3—H3 | 125.4 |
| C16—C17—C18 | 120.2 (3) | C35—N3—H3 | 125.4 |
| C16—C17—H17 | 119.9 | C34—N4—C36 | 106.4 (2) |
| C18—C17—H17 | 119.9 | C34—N4—Ag1 | 129.74 (18) |
| C17—C18—C13 | 120.4 (3) | C36—N4—Ag1 | 123.83 (18) |
| C17—C18—H18 | 119.8 | C12—N5—C10 | 106.9 (2) |
| C13—C18—H18 | 119.8 | C12—N5—Ag2 | 130.1 (2) |
| C20—C19—N1 | 109.5 (3) | C10—N5—Ag2 | 122.3 (2) |
| C20—C19—H19 | 125.3 | C11—N6—C12 | 108.9 (3) |
| N1—C19—H19 | 125.3 | C11—N6—H6 | 125.5 |
| N2—C20—C19 | 106.0 (3) | C12—N6—H6 | 125.5 |
| N2—C20—H20 | 127.0 | C3—N7—C2 | 109.3 (2) |
| C19—C20—H20 | 127.0 | C3—N7—H7 | 125.4 |
| N1—C21—N2 | 109.0 (3) | C2—N7—H7 | 125.4 |
| N1—C21—C22 | 127.8 (3) | C3—N8—C1 | 106.2 (2) |
| N2—C21—C22 | 123.2 (3) | C3—N8—Ag3 | 129.2 (2) |
| C27—C22—C23 | 117.4 (3) | C1—N8—Ag3 | 124.61 (19) |
| C27—C22—C21 | 120.9 (3) | O3—N9—O1 | 121.0 (3) |
| C23—C22—C21 | 121.6 (3) | O3—N9—O2 | 121.6 (3) |
| C24—C23—C22 | 121.5 (3) | O1—N9—O2 | 117.4 (3) |
| C24—C23—H23 | 119.2 | O4—N10—O6 | 122.3 (3) |
| C22—C23—H23 | 119.2 | O4—N10—O5 | 120.1 (3) |
| C25—C24—C23 | 120.0 (3) | O6—N10—O5 | 117.6 (3) |
| C25—C24—H24 | 120.0 |
| H··· | ||||
| N2—H2···O6i | 0.86 | 2.03 | 2.893 (3) | 178 |
| N3—H3···O5iii | 0.86 | 1.95 | 2.812 (3) | 178 |
| N6—H6···O2ii | 0.86 | 1.99 | 2.846 (3) | 173 |
| N7—H7···O1iv | 0.86 | 1.95 | 2.812 (3) | 177 |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| N2—H2⋯O6i | 0.86 | 2.03 | 2.893 (3) | 178 |
| N3—H3⋯O5ii | 0.86 | 1.95 | 2.812 (3) | 178 |
| N6—H6⋯O2iii | 0.86 | 1.99 | 2.846 (3) | 173 |
| N7—H7⋯O1iv | 0.86 | 1.95 | 2.812 (3) | 177 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) .