| Literature DB >> 24764824 |
Yuliia Parashchenko1, Anna Pavlishchuk1, Nadezhda A Bokach2, Matti Haukka3.
Abstract
In the title complex, [Ag(NO3)(C10H9N3)4], the nitrate ligand is found to be disordered over two sets of positions, with occupancy factors of 0.473 (5) and 0.527 (5). The Ag(I) ion is located in a square-pyramidal coordination environment formed by four N atoms from four bis-(pyridin-2-yl)amine ligands and one O atom from a nitrate ligand. Weak inter-actions between the Ag(I) ions and the nitrate anions acting in a monodentate mode [Ag⋯O = 2.791 (13) and 2.816 (9) Å for the major component of the nitrate ligand, and 2.865 (8) and 2.837 (8) Å for the minor component] link the complex mol-ecules into a chain along [001]. N-H⋯O hydrogen bonds are observed.Entities:
Year: 2014 PMID: 24764824 PMCID: PMC3998263 DOI: 10.1107/S1600536814000907
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ag(NO3)(C10H9N3)4] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 1361 reflections |
| θ = 2.3–21.1° | |
| µ = 0.60 mm−1 | |
| β = 104.499 (4)° | Needle, colourless |
| 0.29 × 0.06 × 0.03 mm | |
| Bruker APEXII CCD diffractometer | 6643 independent reflections |
| Radiation source: fine-focus sealed tube | 3690 reflections with |
| Flat graphite crystal monochromator | |
| Detector resolution: 16 pixels mm-1 | θmax = 25.1°, θmin = 1.8° |
| φ and ω scans | |
| Absorption correction: multi-scan ( | |
| 11456 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 | |
| 6643 reflections | (Δ/σ)max < 0.001 |
| 509 parameters | Δρmax = 1.05 e Å−3 |
| 29 restraints | Δρmin = −2.19 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 | 0.17127 (4) | 0.24786 (2) | 0.08079 (4) | 0.02838 (16) | |
| N13A | 0.1669 (9) | 0.2518 (5) | 0.3523 (7) | 0.0369 (9) | 0.473 (5) |
| O1A | 0.1909 (13) | 0.2997 (5) | 0.3987 (10) | 0.0369 (9) | 0.473 (5) |
| O2A | 0.1631 (9) | 0.2582 (4) | 0.2612 (6) | 0.0369 (9) | 0.473 (5) |
| O3A | 0.1481 (8) | 0.2072 (4) | 0.3856 (7) | 0.0369 (9) | 0.473 (5) |
| N13B | 0.1685 (9) | 0.2611 (4) | 0.3255 (7) | 0.0369 (9) | 0.527 (5) |
| O1B | 0.1745 (11) | 0.2885 (5) | 0.3983 (9) | 0.0369 (9) | 0.527 (5) |
| O2B | 0.2496 (7) | 0.2419 (4) | 0.2957 (6) | 0.0369 (9) | 0.527 (5) |
| O3B | 0.0812 (7) | 0.2619 (4) | 0.2508 (6) | 0.0369 (9) | 0.527 (5) |
| N1 | −0.0337 (5) | 0.2501 (3) | 0.0273 (5) | 0.0564 (19) | |
| N2 | −0.0488 (5) | 0.1740 (2) | −0.0804 (4) | 0.0340 (14) | |
| H2 | 0.0246 | 0.1784 | −0.0666 | 0.041* | |
| N3 | −0.2006 (5) | 0.1208 (2) | −0.1780 (4) | 0.0303 (14) | |
| N4 | 0.1850 (5) | 0.1399 (3) | 0.1059 (5) | 0.0432 (17) | |
| N5 | 0.0397 (5) | 0.1353 (3) | 0.1806 (5) | 0.0455 (17) | |
| H5 | 0.0669 | 0.1693 | 0.2037 | 0.055* | |
| N6 | −0.1073 (5) | 0.0700 (3) | 0.1722 (4) | 0.0376 (15) | |
| N7 | 0.3748 (7) | 0.2493 (3) | 0.1219 (6) | 0.093 (3) | |
| N8 | 0.3872 (6) | 0.3217 (3) | 0.0092 (6) | 0.085 (3) | |
| H8 | 0.3194 | 0.3089 | −0.0202 | 0.102* | |
| N9 | 0.5243 (5) | 0.3905 (3) | −0.0021 (5) | 0.0366 (15) | |
| N10 | 0.1604 (7) | 0.3575 (4) | 0.0857 (6) | 0.097 (4) | |
| N11 | 0.2960 (6) | 0.3680 (3) | 0.2315 (5) | 0.061 (2) | |
| H11 | 0.2777 | 0.3318 | 0.2403 | 0.073* | |
| N12 | 0.4227 (5) | 0.4422 (2) | 0.2989 (4) | 0.0365 (15) | |
| C1 | −0.0789 (7) | 0.2885 (4) | 0.0804 (8) | 0.075 (3) | |
| H1 | −0.0312 | 0.3175 | 0.1179 | 0.090* | |
| C2 | −0.1912 (7) | 0.2880 (4) | 0.0834 (8) | 0.069 (3) | |
| H2A | −0.2207 | 0.3164 | 0.1200 | 0.082* | |
| C3 | −0.2571 (6) | 0.2447 (3) | 0.0315 (6) | 0.052 (2) | |
| H3 | −0.3340 | 0.2425 | 0.0324 | 0.062* | |
| C4 | −0.2129 (6) | 0.2042 (3) | −0.0227 (6) | 0.0403 (19) | |
| H4 | −0.2579 | 0.1732 | −0.0568 | 0.048* | |
| C5 | −0.1022 (6) | 0.2099 (3) | −0.0257 (6) | 0.0362 (19) | |
| C6 | −0.0910 (6) | 0.1323 (3) | −0.1533 (5) | 0.0268 (15) | |
| C7 | −0.0146 (6) | 0.1047 (3) | −0.1987 (5) | 0.0268 (15) | |
| H7 | 0.0634 | 0.1136 | −0.1790 | 0.032* | |
| C8 | −0.0560 (6) | 0.0645 (3) | −0.2724 (5) | 0.0318 (17) | |
| H8A | −0.0067 | 0.0453 | −0.3053 | 0.038* | |
| C9 | −0.1701 (6) | 0.0521 (3) | −0.2987 (5) | 0.0305 (17) | |
| H9 | −0.2000 | 0.0242 | −0.3493 | 0.037* | |
| C10 | −0.2385 (6) | 0.0807 (3) | −0.2507 (5) | 0.0332 (18) | |
| H10 | −0.3167 | 0.0722 | −0.2691 | 0.040* | |
| C11 | 0.2549 (6) | 0.1156 (3) | 0.0550 (6) | 0.0358 (18) | |
| H11A | 0.3122 | 0.1393 | 0.0403 | 0.043* | |
| C12 | 0.2479 (5) | 0.0602 (3) | 0.0239 (5) | 0.0306 (16) | |
| H12 | 0.2995 | 0.0450 | −0.0108 | 0.037* | |
| C13 | 0.1633 (6) | 0.0254 (3) | 0.0438 (5) | 0.0324 (18) | |
| H13 | 0.1549 | −0.0137 | 0.0212 | 0.039* | |
| C14 | 0.0918 (5) | 0.0486 (3) | 0.0969 (5) | 0.0298 (16) | |
| H14 | 0.0348 | 0.0253 | 0.1129 | 0.036* | |
| C15 | 0.1037 (6) | 0.1056 (3) | 0.1262 (5) | 0.0349 (18) | |
| C16 | −0.0589 (6) | 0.1202 (3) | 0.2041 (5) | 0.0355 (18) | |
| C17 | −0.1048 (6) | 0.1600 (3) | 0.2615 (6) | 0.043 (2) | |
| H17 | −0.0673 | 0.1955 | 0.2834 | 0.051* | |
| C18 | −0.2037 (6) | 0.1468 (3) | 0.2850 (6) | 0.044 (2) | |
| H18 | −0.2362 | 0.1725 | 0.3240 | 0.053* | |
| C19 | −0.2555 (6) | 0.0941 (3) | 0.2499 (6) | 0.042 (2) | |
| H19 | −0.3252 | 0.0837 | 0.2632 | 0.050* | |
| C20 | −0.2045 (6) | 0.0583 (4) | 0.1966 (6) | 0.044 (2) | |
| H20 | −0.2400 | 0.0223 | 0.1748 | 0.053* | |
| C21 | 0.4230 (9) | 0.2173 (4) | 0.2021 (7) | 0.083 (4) | |
| H21 | 0.3813 | 0.1852 | 0.2171 | 0.100* | |
| C22 | 0.5258 (7) | 0.2263 (3) | 0.2637 (6) | 0.047 (2) | |
| H22 | 0.5548 | 0.2025 | 0.3209 | 0.056* | |
| C23 | 0.5858 (6) | 0.2714 (4) | 0.2398 (6) | 0.049 (2) | |
| H23 | 0.6575 | 0.2800 | 0.2827 | 0.059* | |
| C24 | 0.5457 (6) | 0.3047 (3) | 0.1557 (5) | 0.0355 (17) | |
| H24 | 0.5890 | 0.3356 | 0.1390 | 0.043* | |
| C25 | 0.4404 (7) | 0.2919 (3) | 0.0961 (6) | 0.051 (2) | |
| C26 | 0.4229 (6) | 0.3683 (3) | −0.0391 (6) | 0.0351 (18) | |
| C27 | 0.3477 (6) | 0.3905 (3) | −0.1247 (6) | 0.042 (2) | |
| H27 | 0.2746 | 0.3743 | −0.1484 | 0.050* | |
| C28 | 0.3816 (6) | 0.4356 (3) | −0.1732 (5) | 0.0313 (17) | |
| H28 | 0.3333 | 0.4504 | −0.2333 | 0.038* | |
| C29 | 0.4856 (6) | 0.4602 (3) | −0.1358 (6) | 0.039 (2) | |
| H29 | 0.5097 | 0.4927 | −0.1675 | 0.047* | |
| C30 | 0.5527 (7) | 0.4360 (4) | −0.0511 (6) | 0.049 (2) | |
| H30 | 0.6249 | 0.4526 | −0.0250 | 0.059* | |
| C31 | 0.0905 (9) | 0.3789 (5) | 0.0006 (8) | 0.113 (5) | |
| H31 | 0.0403 | 0.3528 | −0.0421 | 0.136* | |
| C32 | 0.0884 (8) | 0.4364 (5) | −0.0274 (7) | 0.085 (4) | |
| H32 | 0.0382 | 0.4503 | −0.0873 | 0.102* | |
| C33 | 0.1623 (7) | 0.4723 (4) | 0.0356 (7) | 0.053 (2) | |
| H33 | 0.1632 | 0.5124 | 0.0194 | 0.064* | |
| C34 | 0.2357 (6) | 0.4522 (4) | 0.1221 (6) | 0.044 (2) | |
| H34 | 0.2877 | 0.4774 | 0.1648 | 0.053* | |
| C35 | 0.2309 (7) | 0.3937 (4) | 0.1445 (6) | 0.060 (3) | |
| C36 | 0.3838 (6) | 0.3890 (3) | 0.3064 (5) | 0.0314 (16) | |
| C37 | 0.4302 (5) | 0.3523 (3) | 0.3872 (5) | 0.0323 (17) | |
| H37 | 0.4012 | 0.3143 | 0.3898 | 0.039* | |
| C38 | 0.5182 (6) | 0.3718 (3) | 0.4631 (6) | 0.0348 (18) | |
| H38 | 0.5500 | 0.3480 | 0.5196 | 0.042* | |
| C39 | 0.5595 (7) | 0.4273 (3) | 0.4548 (6) | 0.043 (2) | |
| H39 | 0.6208 | 0.4423 | 0.5052 | 0.051* | |
| C40 | 0.5100 (7) | 0.4597 (3) | 0.3725 (6) | 0.043 (2) | |
| H40 | 0.5395 | 0.4974 | 0.3670 | 0.051* |
| Ag1 | 0.0302 (3) | 0.0252 (3) | 0.0316 (3) | −0.0075 (3) | 0.01118 (19) | −0.0037 (3) |
| N13A | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O1A | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O2A | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O3A | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| N13B | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O1B | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O2B | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| O3B | 0.0408 (19) | 0.038 (2) | 0.0324 (19) | −0.008 (2) | 0.0101 (18) | −0.0068 (19) |
| N1 | 0.040 (3) | 0.052 (4) | 0.091 (5) | −0.021 (4) | 0.043 (4) | −0.044 (5) |
| N2 | 0.029 (3) | 0.032 (3) | 0.045 (4) | −0.009 (3) | 0.018 (3) | −0.017 (3) |
| N3 | 0.032 (3) | 0.026 (3) | 0.034 (4) | −0.007 (3) | 0.012 (3) | −0.002 (3) |
| N4 | 0.048 (4) | 0.043 (4) | 0.044 (4) | −0.011 (3) | 0.023 (4) | −0.014 (3) |
| N5 | 0.046 (4) | 0.051 (4) | 0.049 (4) | −0.023 (3) | 0.031 (3) | −0.028 (3) |
| N6 | 0.034 (4) | 0.054 (4) | 0.027 (3) | −0.015 (3) | 0.013 (3) | −0.008 (3) |
| N7 | 0.100 (5) | 0.065 (4) | 0.077 (5) | −0.048 (5) | −0.045 (4) | 0.034 (5) |
| N8 | 0.080 (6) | 0.055 (4) | 0.082 (6) | −0.053 (4) | −0.052 (4) | 0.047 (4) |
| N9 | 0.031 (3) | 0.043 (4) | 0.036 (4) | −0.009 (3) | 0.008 (3) | 0.004 (3) |
| N10 | 0.094 (7) | 0.099 (6) | 0.068 (6) | −0.080 (6) | −0.038 (5) | 0.050 (5) |
| N11 | 0.067 (5) | 0.064 (5) | 0.038 (4) | −0.051 (4) | −0.013 (4) | 0.019 (4) |
| N12 | 0.037 (4) | 0.036 (3) | 0.037 (4) | −0.020 (3) | 0.009 (3) | 0.001 (3) |
| C1 | 0.057 (6) | 0.065 (6) | 0.120 (9) | −0.041 (5) | 0.056 (6) | −0.064 (6) |
| C2 | 0.059 (6) | 0.064 (6) | 0.100 (8) | −0.029 (5) | 0.051 (6) | −0.053 (6) |
| C3 | 0.035 (4) | 0.058 (5) | 0.071 (5) | −0.017 (4) | 0.030 (4) | −0.031 (5) |
| C4 | 0.040 (4) | 0.038 (4) | 0.049 (5) | −0.014 (3) | 0.023 (4) | −0.019 (4) |
| C5 | 0.038 (4) | 0.029 (4) | 0.051 (5) | −0.015 (3) | 0.029 (4) | −0.018 (4) |
| C6 | 0.036 (4) | 0.018 (3) | 0.029 (4) | 0.000 (3) | 0.013 (3) | −0.001 (3) |
| C7 | 0.031 (4) | 0.019 (3) | 0.033 (4) | −0.003 (3) | 0.012 (3) | −0.006 (3) |
| C8 | 0.044 (5) | 0.023 (4) | 0.034 (4) | −0.004 (3) | 0.021 (4) | −0.002 (3) |
| C9 | 0.051 (5) | 0.019 (3) | 0.021 (4) | 0.000 (3) | 0.007 (4) | −0.001 (3) |
| C10 | 0.041 (5) | 0.019 (3) | 0.038 (5) | −0.005 (3) | 0.007 (4) | −0.004 (3) |
| C11 | 0.029 (4) | 0.035 (4) | 0.048 (5) | −0.006 (3) | 0.019 (4) | −0.002 (4) |
| C12 | 0.024 (4) | 0.034 (4) | 0.034 (4) | −0.002 (3) | 0.005 (3) | −0.004 (3) |
| C13 | 0.030 (4) | 0.029 (4) | 0.031 (4) | 0.002 (3) | −0.004 (4) | 0.004 (3) |
| C14 | 0.026 (4) | 0.035 (4) | 0.029 (4) | −0.007 (3) | 0.008 (3) | 0.007 (3) |
| C15 | 0.028 (4) | 0.051 (5) | 0.027 (4) | −0.017 (4) | 0.011 (3) | −0.011 (4) |
| C16 | 0.025 (4) | 0.057 (5) | 0.025 (4) | −0.013 (3) | 0.008 (3) | −0.002 (4) |
| C17 | 0.045 (5) | 0.047 (5) | 0.042 (5) | −0.015 (4) | 0.021 (4) | −0.010 (4) |
| C18 | 0.036 (4) | 0.059 (5) | 0.042 (5) | −0.002 (4) | 0.019 (4) | 0.004 (4) |
| C19 | 0.028 (4) | 0.062 (6) | 0.037 (5) | −0.006 (4) | 0.012 (4) | 0.012 (4) |
| C20 | 0.032 (4) | 0.061 (5) | 0.037 (5) | −0.018 (4) | 0.005 (4) | −0.003 (4) |
| C21 | 0.109 (9) | 0.046 (5) | 0.057 (6) | −0.044 (5) | −0.049 (6) | 0.024 (5) |
| C22 | 0.054 (5) | 0.038 (4) | 0.042 (5) | 0.010 (4) | 0.002 (4) | 0.012 (4) |
| C23 | 0.030 (4) | 0.076 (6) | 0.035 (5) | 0.004 (4) | −0.001 (4) | 0.006 (4) |
| C24 | 0.029 (4) | 0.043 (4) | 0.035 (4) | 0.002 (3) | 0.009 (3) | 0.002 (4) |
| C25 | 0.063 (6) | 0.031 (4) | 0.041 (5) | −0.019 (4) | −0.023 (4) | 0.009 (4) |
| C26 | 0.038 (4) | 0.021 (4) | 0.041 (5) | −0.008 (3) | 0.000 (4) | 0.003 (3) |
| C27 | 0.033 (4) | 0.033 (4) | 0.050 (5) | −0.009 (3) | −0.010 (4) | 0.020 (4) |
| C28 | 0.036 (4) | 0.029 (4) | 0.030 (4) | 0.002 (3) | 0.009 (3) | 0.004 (3) |
| C29 | 0.046 (5) | 0.038 (4) | 0.038 (5) | −0.011 (4) | 0.018 (4) | 0.003 (4) |
| C30 | 0.040 (5) | 0.061 (6) | 0.044 (6) | −0.024 (4) | 0.005 (4) | 0.006 (5) |
| C31 | 0.101 (9) | 0.120 (10) | 0.080 (8) | −0.073 (8) | −0.052 (7) | 0.058 (7) |
| C32 | 0.055 (6) | 0.117 (9) | 0.065 (7) | −0.050 (6) | −0.017 (5) | 0.053 (6) |
| C33 | 0.040 (5) | 0.075 (6) | 0.050 (6) | −0.003 (5) | 0.021 (5) | 0.031 (5) |
| C34 | 0.034 (4) | 0.061 (5) | 0.040 (5) | −0.014 (4) | 0.011 (4) | 0.009 (4) |
| C35 | 0.057 (6) | 0.077 (6) | 0.039 (5) | −0.036 (5) | 0.001 (4) | 0.034 (5) |
| C36 | 0.032 (4) | 0.035 (4) | 0.027 (4) | −0.010 (3) | 0.007 (3) | 0.000 (3) |
| C37 | 0.029 (4) | 0.036 (4) | 0.033 (4) | −0.009 (3) | 0.010 (3) | −0.007 (3) |
| C38 | 0.036 (4) | 0.037 (4) | 0.033 (4) | 0.009 (3) | 0.013 (4) | −0.003 (3) |
| C39 | 0.044 (5) | 0.043 (5) | 0.036 (5) | −0.015 (4) | 0.002 (4) | −0.003 (4) |
| C40 | 0.054 (5) | 0.043 (5) | 0.032 (5) | −0.021 (4) | 0.013 (4) | −0.003 (4) |
| Ag1—N7 | 2.420 (9) | C8—H8A | 0.9500 |
| Ag1—N1 | 2.439 (6) | C9—C10 | 1.361 (9) |
| Ag1—N4 | 2.511 (6) | C9—H9 | 0.9500 |
| Ag1—N10 | 2.532 (9) | C10—H10 | 0.9500 |
| Ag1—O2A | 2.511 (8) | C11—C12 | 1.343 (9) |
| Ag1—O1Bi | 2.648 (12) | C11—H11A | 0.9500 |
| N13A—O3A | 1.172 (11) | C12—C13 | 1.392 (9) |
| N13A—O2A | 1.247 (11) | C12—H12 | 0.9500 |
| N13A—O1A | 1.269 (12) | C13—C14 | 1.381 (9) |
| N13B—O1B | 1.168 (11) | C13—H13 | 0.9500 |
| N13B—O2B | 1.248 (10) | C14—C15 | 1.372 (9) |
| N13B—O3B | 1.284 (11) | C14—H14 | 0.9500 |
| N1—C5 | 1.337 (8) | C16—C17 | 1.414 (10) |
| N1—C1 | 1.350 (9) | C17—C18 | 1.367 (9) |
| N2—C5 | 1.386 (8) | C17—H17 | 0.9500 |
| N2—C6 | 1.389 (8) | C18—C19 | 1.397 (10) |
| N2—H2 | 0.8800 | C18—H18 | 0.9500 |
| N3—C6 | 1.330 (8) | C19—C20 | 1.356 (10) |
| N3—C10 | 1.352 (8) | C19—H19 | 0.9500 |
| N4—C11 | 1.355 (8) | C20—H20 | 0.9500 |
| N4—C15 | 1.355 (8) | C21—C22 | 1.347 (11) |
| N5—C16 | 1.374 (8) | C21—H21 | 0.9500 |
| N5—C15 | 1.391 (8) | C22—C23 | 1.360 (11) |
| N5—H5 | 0.8800 | C22—H22 | 0.9500 |
| N6—C16 | 1.325 (9) | C23—C24 | 1.371 (10) |
| N6—C20 | 1.344 (9) | C23—H23 | 0.9500 |
| N7—C21 | 1.335 (10) | C24—C25 | 1.378 (10) |
| N7—C25 | 1.371 (10) | C24—H24 | 0.9500 |
| N8—C25 | 1.388 (9) | C26—C27 | 1.395 (9) |
| N8—C26 | 1.390 (9) | C27—C28 | 1.355 (9) |
| N8—H8 | 0.8800 | C27—H27 | 0.9500 |
| N9—C26 | 1.325 (8) | C28—C29 | 1.373 (10) |
| N9—C30 | 1.337 (9) | C28—H28 | 0.9500 |
| N10—C35 | 1.320 (10) | C29—C30 | 1.363 (11) |
| N10—C31 | 1.357 (11) | C29—H29 | 0.9500 |
| N11—C36 | 1.377 (9) | C30—H30 | 0.9500 |
| N11—C35 | 1.389 (10) | C31—C32 | 1.377 (13) |
| N11—H11 | 0.8800 | C31—H31 | 0.9500 |
| N12—C36 | 1.330 (8) | C32—C33 | 1.366 (12) |
| N12—C40 | 1.337 (9) | C32—H32 | 0.9500 |
| C1—C2 | 1.390 (11) | C33—C34 | 1.378 (11) |
| C1—H1 | 0.9500 | C33—H33 | 0.9500 |
| C2—C3 | 1.366 (10) | C34—C35 | 1.387 (11) |
| C2—H2A | 0.9500 | C34—H34 | 0.9500 |
| C3—C4 | 1.385 (9) | C36—C37 | 1.396 (9) |
| C3—H3 | 0.9500 | C37—C38 | 1.374 (9) |
| C4—C5 | 1.377 (9) | C37—H37 | 0.9500 |
| C4—H4 | 0.9500 | C38—C39 | 1.391 (9) |
| C6—C7 | 1.401 (8) | C38—H38 | 0.9500 |
| C7—C8 | 1.371 (9) | C39—C40 | 1.362 (10) |
| C7—H7 | 0.9500 | C39—H39 | 0.9500 |
| C8—C9 | 1.387 (9) | C40—H40 | 0.9500 |
| N7—Ag1—N1 | 175.6 (3) | C12—C13—H13 | 120.5 |
| N7—Ag1—N4 | 87.2 (2) | C15—C14—C13 | 119.3 (6) |
| N1—Ag1—N4 | 95.2 (2) | C15—C14—H14 | 120.3 |
| N7—Ag1—O2A | 93.6 (3) | C13—C14—H14 | 120.3 |
| N1—Ag1—O2A | 90.1 (3) | N4—C15—C14 | 121.9 (6) |
| N4—Ag1—O2A | 88.7 (3) | N4—C15—N5 | 111.6 (6) |
| N7—Ag1—N10 | 92.2 (3) | C14—C15—N5 | 126.5 (6) |
| N1—Ag1—N10 | 86.0 (2) | N6—C16—N5 | 119.5 (6) |
| N4—Ag1—N10 | 170.8 (2) | N6—C16—C17 | 122.8 (6) |
| O2A—Ag1—N10 | 82.2 (3) | N5—C16—C17 | 117.7 (6) |
| O3A—N13A—O2A | 122.1 (10) | C18—C17—C16 | 119.2 (7) |
| O3A—N13A—O1A | 127.7 (10) | C18—C17—H17 | 120.4 |
| O2A—N13A—O1A | 110.2 (11) | C16—C17—H17 | 120.4 |
| N13A—O2A—Ag1 | 167.1 (8) | C17—C18—C19 | 117.8 (7) |
| O1B—N13B—O2B | 125.9 (11) | C17—C18—H18 | 121.1 |
| O1B—N13B—O3B | 122.3 (11) | C19—C18—H18 | 121.1 |
| O2B—N13B—O3B | 108.6 (8) | C20—C19—C18 | 118.9 (7) |
| C5—N1—C1 | 117.3 (6) | C20—C19—H19 | 120.6 |
| C5—N1—Ag1 | 127.6 (5) | C18—C19—H19 | 120.6 |
| C1—N1—Ag1 | 112.6 (5) | N6—C20—C19 | 124.8 (7) |
| C5—N2—C6 | 131.3 (6) | N6—C20—H20 | 117.6 |
| C5—N2—H2 | 114.4 | C19—C20—H20 | 117.6 |
| C6—N2—H2 | 114.4 | N7—C21—C22 | 125.7 (8) |
| C6—N3—C10 | 117.6 (6) | N7—C21—H21 | 117.1 |
| C11—N4—C15 | 117.4 (6) | C22—C21—H21 | 117.1 |
| C11—N4—Ag1 | 111.6 (4) | C21—C22—C23 | 116.5 (8) |
| C15—N4—Ag1 | 125.3 (5) | C21—C22—H22 | 121.8 |
| C16—N5—C15 | 130.7 (6) | C23—C22—H22 | 121.8 |
| C16—N5—H5 | 114.7 | C22—C23—C24 | 121.9 (7) |
| C15—N5—H5 | 114.7 | C22—C23—H23 | 119.0 |
| C16—N6—C20 | 116.4 (6) | C24—C23—H23 | 119.0 |
| C21—N7—C25 | 116.1 (7) | C23—C24—C25 | 117.7 (7) |
| C21—N7—Ag1 | 113.8 (7) | C23—C24—H24 | 121.2 |
| C25—N7—Ag1 | 126.1 (6) | C25—C24—H24 | 121.2 |
| C25—N8—C26 | 130.9 (7) | N7—C25—C24 | 121.7 (7) |
| C25—N8—H8 | 114.5 | N7—C25—N8 | 113.3 (7) |
| C26—N8—H8 | 114.5 | C24—C25—N8 | 124.9 (7) |
| C26—N9—C30 | 116.6 (7) | N9—C26—N8 | 119.6 (7) |
| C35—N10—C31 | 118.3 (9) | N9—C26—C27 | 122.8 (6) |
| C35—N10—Ag1 | 127.9 (7) | N8—C26—C27 | 117.6 (6) |
| C31—N10—Ag1 | 111.4 (7) | C28—C27—C26 | 118.2 (7) |
| C36—N11—C35 | 131.8 (7) | C28—C27—H27 | 120.9 |
| C36—N11—H11 | 114.1 | C26—C27—H27 | 120.9 |
| C35—N11—H11 | 114.1 | C27—C28—C29 | 120.3 (7) |
| C36—N12—C40 | 117.1 (6) | C27—C28—H28 | 119.8 |
| N1—C1—C2 | 123.8 (7) | C29—C28—H28 | 119.8 |
| N1—C1—H1 | 118.1 | C30—C29—C28 | 117.1 (7) |
| C2—C1—H1 | 118.1 | C30—C29—H29 | 121.4 |
| C3—C2—C1 | 116.9 (7) | C28—C29—H29 | 121.4 |
| C3—C2—H2A | 121.5 | N9—C30—C29 | 124.8 (7) |
| C1—C2—H2A | 121.5 | N9—C30—H30 | 117.6 |
| C2—C3—C4 | 120.8 (7) | C29—C30—H30 | 117.6 |
| C2—C3—H3 | 119.6 | N10—C31—C32 | 123.5 (9) |
| C4—C3—H3 | 119.6 | N10—C31—H31 | 118.3 |
| C5—C4—C3 | 118.2 (6) | C32—C31—H31 | 118.3 |
| C5—C4—H4 | 120.9 | C33—C32—C31 | 116.4 (9) |
| C3—C4—H4 | 120.9 | C33—C32—H32 | 121.8 |
| N1—C5—C4 | 122.8 (6) | C31—C32—H32 | 121.8 |
| N1—C5—N2 | 112.8 (6) | C32—C33—C34 | 121.9 (9) |
| C4—C5—N2 | 124.3 (6) | C32—C33—H33 | 119.1 |
| N3—C6—N2 | 119.5 (6) | C34—C33—H33 | 119.1 |
| N3—C6—C7 | 122.9 (6) | C33—C34—C35 | 117.6 (8) |
| N2—C6—C7 | 117.6 (6) | C33—C34—H34 | 121.2 |
| C8—C7—C6 | 117.9 (6) | C35—C34—H34 | 121.2 |
| C8—C7—H7 | 121.0 | N10—C35—C34 | 122.3 (8) |
| C6—C7—H7 | 121.0 | N10—C35—N11 | 113.9 (8) |
| C7—C8—C9 | 119.6 (6) | C34—C35—N11 | 123.8 (8) |
| C7—C8—H8A | 120.2 | N12—C36—N11 | 119.6 (6) |
| C9—C8—H8A | 120.2 | N12—C36—C37 | 122.4 (6) |
| C10—C9—C8 | 118.7 (6) | N11—C36—C37 | 117.9 (6) |
| C10—C9—H9 | 120.6 | C38—C37—C36 | 119.4 (6) |
| C8—C9—H9 | 120.6 | C38—C37—H37 | 120.3 |
| N3—C10—C9 | 123.2 (7) | C36—C37—H37 | 120.3 |
| N3—C10—H10 | 118.4 | C37—C38—C39 | 118.2 (7) |
| C9—C10—H10 | 118.4 | C37—C38—H38 | 120.9 |
| C12—C11—N4 | 123.9 (6) | C39—C38—H38 | 120.9 |
| C12—C11—H11A | 118.1 | C40—C39—C38 | 118.4 (7) |
| N4—C11—H11A | 118.1 | C40—C39—H39 | 120.8 |
| C11—C12—C13 | 118.5 (6) | C38—C39—H39 | 120.8 |
| C11—C12—H12 | 120.7 | N12—C40—C39 | 124.6 (7) |
| C13—C12—H12 | 120.7 | N12—C40—H40 | 117.7 |
| C14—C13—C12 | 119.0 (6) | C39—C40—H40 | 117.7 |
| C14—C13—H13 | 120.5 |
| H··· | ||||
| N2—H2···O1 | 0.88 | 2.15 | 2.959 (14) | 152 |
| N2—H2···O1 | 0.88 | 2.27 | 3.089 (16) | 155 |
| N5—H5···O3 | 0.88 | 2.22 | 3.075 (10) | 163 |
| N5—H5···O2 | 0.88 | 2.40 | 3.271 (11) | 172 |
| N8—H8···O3 | 0.88 | 2.21 | 3.073 (12) | 168 |
| N11—H11···O2 | 0.88 | 2.26 | 3.129 (10) | 168 |
| N11—H11···O2 | 0.88 | 2.27 | 3.093 (11) | 156 |
Hydrogen-bond geometry (Å, °)
|
|
| H⋯ |
|
|
|---|---|---|---|---|
| N2—H2⋯O1 | 0.88 | 2.15 | 2.959 (14) | 152 |
| N2—H2⋯O1 | 0.88 | 2.27 | 3.089 (16) | 155 |
| N5—H5⋯O3 | 0.88 | 2.22 | 3.075 (10) | 163 |
| N5—H5⋯O2 | 0.88 | 2.40 | 3.271 (11) | 172 |
| N8—H8⋯O3 | 0.88 | 2.21 | 3.073 (12) | 168 |
| N11—H11⋯O2 | 0.88 | 2.26 | 3.129 (10) | 168 |
| N11—H11⋯O2 | 0.88 | 2.27 | 3.093 (11) | 156 |
Symmetry code: (i) .