| Literature DB >> 21754287 |
Nor Asiken Abdul Wahab, Ibrahim Baba, Mohamed Ibrahim Mohamed Tahir, Edward R T Tiekink.
Abstract
The Cd(II) atom in the title compound, [Cd(C(5)H(10)NS(2))(2)(C(10)H(8)N(2))], exists in an N(2)S(4) donor set defined by two chelating dithio-carbamate anions as well as a 2,2'-bipyridine ligand. The coordination geometry approximates a trigonal prism. The crystal packing features weak C-H⋯S inter-actions, leading to linear supra-molecular chains along the a axis. The primary connections between these are by π-π stacking inter-actions [ring centroid distance between centrosymmetrically related pyridyl rings = 3.7455 (10) Å]. Overall, the crystal structure may be described as comprising double layers of mol-ecules that stack along the b axis.Entities:
Year: 2011 PMID: 21754287 PMCID: PMC3089361 DOI: 10.1107/S1600536811012414
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Cd(C5H10NS2)2(C10H8N2)] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2yn | Cell parameters from 26576 reflections |
| θ = 2–29° | |
| µ = 1.23 mm−1 | |
| β = 112.860 (2)° | Prism, yellow |
| 0.17 × 0.13 × 0.05 mm | |
| Oxford Diffraction Xcaliber Eos Gemini diffractometer | 5700 independent reflections |
| Radiation source: fine-focus sealed tube | 5013 reflections with |
| graphite | |
| Detector resolution: 16.1952 pixels mm-1 | θmax = 27.5°, θmin = 2.4° |
| ω scans | |
| Absorption correction: multi-scan ( | |
| 53095 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 | |
| 5700 reflections | (Δ/σ)max = 0.002 |
| 268 parameters | Δρmax = 0.42 e Å−3 |
| 0 restraints | Δρmin = −0.30 e Å−3 |
| Geometry. All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell s.u.'s are taken into account individually in the estimation of s.u.'s in distances, angles and torsion angles; correlations between s.u.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell s.u.'s is used for estimating s.u.'s involving l.s. planes. |
| Refinement. Refinement of |
| Cd | 1.074719 (14) | 0.619541 (4) | 0.837624 (13) | 0.02469 (5) | |
| S1 | 1.13178 (5) | 0.638504 (17) | 1.11803 (5) | 0.02979 (10) | |
| S2 | 1.37352 (5) | 0.615697 (17) | 1.01159 (5) | 0.03243 (10) | |
| S3 | 0.88132 (5) | 0.688040 (16) | 0.71256 (5) | 0.03348 (11) | |
| S4 | 1.10292 (5) | 0.651618 (17) | 0.59657 (5) | 0.03368 (11) | |
| N1 | 1.42420 (16) | 0.63344 (5) | 1.29241 (16) | 0.0285 (3) | |
| N2 | 0.91865 (17) | 0.72387 (5) | 0.47972 (17) | 0.0313 (3) | |
| N3 | 1.09345 (17) | 0.54076 (5) | 0.75929 (16) | 0.0282 (3) | |
| N4 | 0.87517 (16) | 0.56931 (5) | 0.84481 (16) | 0.0292 (3) | |
| C1 | 1.32019 (19) | 0.62947 (6) | 1.15504 (19) | 0.0254 (3) | |
| C2 | 1.5853 (2) | 0.63217 (9) | 1.3206 (2) | 0.0448 (5) | |
| H2A | 1.6125 | 0.6009 | 1.2987 | 0.067* | |
| H2B | 1.6444 | 0.6397 | 1.4245 | 0.067* | |
| H2C | 1.6070 | 0.6551 | 1.2573 | 0.067* | |
| C3 | 1.3829 (2) | 0.64480 (7) | 1.41991 (19) | 0.0296 (4) | |
| H3 | 1.2720 | 0.6392 | 1.3881 | 0.036* | |
| C4 | 1.4639 (3) | 0.61310 (9) | 1.5506 (3) | 0.0521 (6) | |
| H4A | 1.4428 | 0.5804 | 1.5198 | 0.078* | |
| H4B | 1.4281 | 0.6196 | 1.6296 | 0.078* | |
| H4C | 1.5729 | 0.6188 | 1.5870 | 0.078* | |
| C5 | 1.4115 (2) | 0.69603 (7) | 1.4595 (2) | 0.0414 (5) | |
| H5A | 1.5206 | 0.7020 | 1.5016 | 0.062* | |
| H5B | 1.3688 | 0.7042 | 1.5322 | 0.062* | |
| H5C | 1.3637 | 0.7151 | 1.3705 | 0.062* | |
| C6 | 0.96267 (19) | 0.69114 (6) | 0.58500 (19) | 0.0253 (3) | |
| C7 | 0.7956 (2) | 0.75621 (7) | 0.4673 (3) | 0.0439 (5) | |
| H7A | 0.7009 | 0.7388 | 0.4401 | 0.066* | |
| H7B | 0.7853 | 0.7796 | 0.3912 | 0.066* | |
| H7C | 0.8185 | 0.7718 | 0.5624 | 0.066* | |
| C8 | 0.9824 (2) | 0.72780 (7) | 0.3644 (2) | 0.0374 (5) | |
| H8 | 1.0722 | 0.7067 | 0.3931 | 0.045* | |
| C9 | 1.0361 (3) | 0.77737 (8) | 0.3560 (2) | 0.0491 (6) | |
| H9A | 0.9485 | 0.7980 | 0.3128 | 0.074* | |
| H9B | 1.0953 | 0.7777 | 0.2942 | 0.074* | |
| H9C | 1.0991 | 0.7883 | 0.4557 | 0.074* | |
| C10 | 0.8681 (3) | 0.71105 (8) | 0.2173 (2) | 0.0455 (5) | |
| H10A | 0.8415 | 0.6785 | 0.2264 | 0.068* | |
| H10B | 0.9116 | 0.7133 | 0.1423 | 0.068* | |
| H10C | 0.7772 | 0.7305 | 0.1880 | 0.068* | |
| C11 | 1.1989 (2) | 0.52925 (7) | 0.7083 (2) | 0.0359 (4) | |
| H11 | 1.2712 | 0.5522 | 0.7104 | 0.043* | |
| C12 | 1.2078 (2) | 0.48551 (7) | 0.6527 (2) | 0.0405 (5) | |
| H12 | 1.2837 | 0.4786 | 0.6162 | 0.049* | |
| C13 | 1.1038 (2) | 0.45225 (7) | 0.6515 (2) | 0.0405 (5) | |
| H13 | 1.1069 | 0.4218 | 0.6140 | 0.049* | |
| C14 | 0.9948 (2) | 0.46353 (6) | 0.7053 (2) | 0.0349 (4) | |
| H14 | 0.9226 | 0.4409 | 0.7059 | 0.042* | |
| C15 | 0.99217 (19) | 0.50838 (6) | 0.75862 (18) | 0.0269 (4) | |
| C16 | 0.87718 (19) | 0.52370 (6) | 0.81662 (18) | 0.0265 (4) | |
| C17 | 0.7754 (2) | 0.58528 (7) | 0.8983 (2) | 0.0355 (4) | |
| H17 | 0.7746 | 0.6177 | 0.9183 | 0.043* | |
| C18 | 0.6735 (2) | 0.55653 (8) | 0.9256 (2) | 0.0394 (5) | |
| H18 | 0.6034 | 0.5689 | 0.9627 | 0.047* | |
| C19 | 0.6762 (2) | 0.50964 (8) | 0.8977 (2) | 0.0436 (5) | |
| H19 | 0.6081 | 0.4890 | 0.9161 | 0.052* | |
| C20 | 0.7787 (2) | 0.49272 (7) | 0.8427 (2) | 0.0387 (4) | |
| H20 | 0.7819 | 0.4603 | 0.8230 | 0.046* |
| Cd | 0.02824 (7) | 0.02325 (7) | 0.02276 (7) | 0.00063 (5) | 0.01010 (5) | 0.00100 (5) |
| S1 | 0.0242 (2) | 0.0389 (3) | 0.0253 (2) | 0.00347 (18) | 0.00845 (17) | −0.00182 (18) |
| S2 | 0.0316 (2) | 0.0385 (3) | 0.0299 (2) | 0.00315 (19) | 0.01483 (19) | −0.00517 (19) |
| S3 | 0.0408 (3) | 0.0309 (2) | 0.0352 (3) | 0.0088 (2) | 0.0218 (2) | 0.00636 (19) |
| S4 | 0.0373 (2) | 0.0349 (2) | 0.0347 (2) | 0.01276 (19) | 0.0204 (2) | 0.01318 (19) |
| N1 | 0.0226 (7) | 0.0347 (8) | 0.0274 (8) | −0.0005 (6) | 0.0089 (6) | −0.0037 (6) |
| N2 | 0.0307 (8) | 0.0292 (8) | 0.0381 (9) | 0.0075 (6) | 0.0177 (7) | 0.0115 (6) |
| N3 | 0.0329 (8) | 0.0267 (8) | 0.0280 (8) | 0.0006 (6) | 0.0150 (6) | 0.0020 (6) |
| N4 | 0.0288 (8) | 0.0293 (8) | 0.0291 (8) | 0.0015 (6) | 0.0108 (6) | 0.0016 (6) |
| C1 | 0.0267 (8) | 0.0203 (8) | 0.0291 (9) | −0.0001 (6) | 0.0109 (7) | 0.0008 (6) |
| C2 | 0.0228 (9) | 0.0629 (14) | 0.0460 (12) | 0.0012 (9) | 0.0103 (9) | −0.0117 (10) |
| C3 | 0.0255 (8) | 0.0390 (10) | 0.0239 (9) | 0.0000 (7) | 0.0091 (7) | 0.0016 (7) |
| C4 | 0.0520 (14) | 0.0628 (15) | 0.0412 (13) | 0.0102 (11) | 0.0177 (11) | 0.0200 (11) |
| C5 | 0.0482 (12) | 0.0441 (12) | 0.0366 (11) | −0.0062 (9) | 0.0217 (9) | −0.0101 (9) |
| C6 | 0.0257 (8) | 0.0213 (8) | 0.0284 (9) | −0.0028 (6) | 0.0099 (7) | −0.0003 (7) |
| C7 | 0.0452 (12) | 0.0355 (11) | 0.0595 (14) | 0.0161 (9) | 0.0297 (11) | 0.0192 (10) |
| C8 | 0.0332 (10) | 0.0431 (11) | 0.0405 (11) | 0.0109 (8) | 0.0191 (9) | 0.0195 (9) |
| C9 | 0.0434 (12) | 0.0626 (15) | 0.0373 (12) | −0.0150 (11) | 0.0115 (10) | 0.0146 (10) |
| C10 | 0.0553 (13) | 0.0397 (12) | 0.0475 (13) | 0.0006 (10) | 0.0265 (11) | 0.0006 (9) |
| C11 | 0.0420 (11) | 0.0308 (10) | 0.0415 (11) | 0.0001 (8) | 0.0234 (9) | 0.0012 (8) |
| C12 | 0.0468 (12) | 0.0376 (11) | 0.0445 (12) | 0.0083 (9) | 0.0259 (10) | 0.0009 (9) |
| C13 | 0.0465 (12) | 0.0287 (10) | 0.0446 (12) | 0.0072 (9) | 0.0160 (10) | −0.0030 (8) |
| C14 | 0.0350 (10) | 0.0259 (9) | 0.0404 (11) | −0.0001 (8) | 0.0110 (8) | −0.0009 (8) |
| C15 | 0.0291 (9) | 0.0249 (9) | 0.0231 (8) | 0.0017 (7) | 0.0061 (7) | 0.0044 (7) |
| C16 | 0.0248 (8) | 0.0267 (9) | 0.0248 (9) | 0.0025 (7) | 0.0062 (7) | 0.0052 (7) |
| C17 | 0.0343 (10) | 0.0365 (10) | 0.0370 (11) | 0.0046 (8) | 0.0154 (8) | 0.0001 (8) |
| C18 | 0.0298 (10) | 0.0513 (13) | 0.0397 (11) | 0.0089 (9) | 0.0164 (8) | 0.0089 (9) |
| C19 | 0.0337 (10) | 0.0461 (12) | 0.0551 (13) | 0.0011 (9) | 0.0216 (10) | 0.0161 (10) |
| C20 | 0.0355 (10) | 0.0303 (10) | 0.0513 (12) | 0.0015 (8) | 0.0181 (9) | 0.0084 (9) |
| Cd—S1 | 2.6463 (5) | C5—H5C | 0.9800 |
| Cd—S2 | 2.7128 (5) | C7—H7A | 0.9800 |
| Cd—S3 | 2.6518 (5) | C7—H7B | 0.9800 |
| Cd—S4 | 2.6490 (5) | C7—H7C | 0.9800 |
| Cd—N3 | 2.4122 (14) | C8—C10 | 1.512 (3) |
| Cd—N4 | 2.4191 (15) | C8—C9 | 1.523 (3) |
| S1—C1 | 1.7215 (18) | C8—H8 | 1.0000 |
| S2—C1 | 1.7212 (18) | C9—H9A | 0.9800 |
| S3—C6 | 1.7168 (18) | C9—H9B | 0.9800 |
| S4—C6 | 1.7290 (17) | C9—H9C | 0.9800 |
| N1—C1 | 1.335 (2) | C10—H10A | 0.9800 |
| N1—C2 | 1.463 (2) | C10—H10B | 0.9800 |
| N1—C3 | 1.488 (2) | C10—H10C | 0.9800 |
| N2—C6 | 1.336 (2) | C11—C12 | 1.382 (3) |
| N2—C7 | 1.469 (2) | C11—H11 | 0.9500 |
| N2—C8 | 1.486 (2) | C12—C13 | 1.377 (3) |
| N3—C11 | 1.334 (2) | C12—H12 | 0.9500 |
| N3—C15 | 1.342 (2) | C13—C14 | 1.382 (3) |
| N4—C16 | 1.337 (2) | C13—H13 | 0.9500 |
| N4—C17 | 1.340 (2) | C14—C15 | 1.390 (2) |
| C2—H2A | 0.9800 | C14—H14 | 0.9500 |
| C2—H2B | 0.9800 | C15—C16 | 1.492 (2) |
| C2—H2C | 0.9800 | C16—C20 | 1.391 (3) |
| C3—C5 | 1.515 (3) | C17—C18 | 1.382 (3) |
| C3—C4 | 1.516 (3) | C17—H17 | 0.9500 |
| C3—H3 | 1.0000 | C18—C19 | 1.372 (3) |
| C4—H4A | 0.9800 | C18—H18 | 0.9500 |
| C4—H4B | 0.9800 | C19—C20 | 1.382 (3) |
| C4—H4C | 0.9800 | C19—H19 | 0.9500 |
| C5—H5A | 0.9800 | C20—H20 | 0.9500 |
| C5—H5B | 0.9800 | ||
| N3—Cd—N4 | 67.15 (5) | N2—C6—S3 | 120.24 (13) |
| N3—Cd—S1 | 120.84 (4) | N2—C6—S4 | 120.93 (13) |
| N4—Cd—S1 | 86.43 (4) | S3—C6—S4 | 118.83 (10) |
| N3—Cd—S4 | 89.60 (4) | N2—C7—H7A | 109.5 |
| N4—Cd—S4 | 126.11 (4) | N2—C7—H7B | 109.5 |
| S1—Cd—S4 | 143.780 (17) | H7A—C7—H7B | 109.5 |
| N3—Cd—S3 | 132.02 (4) | N2—C7—H7C | 109.5 |
| N4—Cd—S3 | 91.86 (4) | H7A—C7—H7C | 109.5 |
| S1—Cd—S3 | 98.905 (15) | H7B—C7—H7C | 109.5 |
| S4—Cd—S3 | 68.057 (14) | N2—C8—C10 | 110.03 (16) |
| N3—Cd—S2 | 88.34 (4) | N2—C8—C9 | 111.10 (17) |
| N4—Cd—S2 | 127.89 (4) | C10—C8—C9 | 112.31 (16) |
| S1—Cd—S2 | 67.192 (14) | N2—C8—H8 | 107.7 |
| S4—Cd—S2 | 97.251 (15) | C10—C8—H8 | 107.7 |
| S3—Cd—S2 | 134.517 (16) | C9—C8—H8 | 107.7 |
| C1—S1—Cd | 87.98 (6) | C8—C9—H9A | 109.5 |
| C1—S2—Cd | 85.84 (6) | C8—C9—H9B | 109.5 |
| C6—S3—Cd | 86.59 (6) | H9A—C9—H9B | 109.5 |
| C6—S4—Cd | 86.44 (6) | C8—C9—H9C | 109.5 |
| C1—N1—C2 | 120.67 (15) | H9A—C9—H9C | 109.5 |
| C1—N1—C3 | 121.93 (14) | H9B—C9—H9C | 109.5 |
| C2—N1—C3 | 117.02 (14) | C8—C10—H10A | 109.5 |
| C6—N2—C7 | 120.58 (15) | C8—C10—H10B | 109.5 |
| C6—N2—C8 | 122.85 (15) | H10A—C10—H10B | 109.5 |
| C7—N2—C8 | 116.46 (14) | C8—C10—H10C | 109.5 |
| C11—N3—C15 | 118.85 (16) | H10A—C10—H10C | 109.5 |
| C11—N3—Cd | 120.81 (12) | H10B—C10—H10C | 109.5 |
| C15—N3—Cd | 120.24 (11) | N3—C11—C12 | 123.01 (18) |
| C16—N4—C17 | 118.99 (16) | N3—C11—H11 | 118.5 |
| C16—N4—Cd | 119.95 (11) | C12—C11—H11 | 118.5 |
| C17—N4—Cd | 120.30 (12) | C13—C12—C11 | 118.27 (19) |
| N1—C1—S2 | 120.15 (13) | C13—C12—H12 | 120.9 |
| N1—C1—S1 | 120.87 (13) | C11—C12—H12 | 120.9 |
| S2—C1—S1 | 118.97 (10) | C12—C13—C14 | 119.36 (18) |
| N1—C2—H2A | 109.5 | C12—C13—H13 | 120.3 |
| N1—C2—H2B | 109.5 | C14—C13—H13 | 120.3 |
| H2A—C2—H2B | 109.5 | C13—C14—C15 | 119.15 (18) |
| N1—C2—H2C | 109.5 | C13—C14—H14 | 120.4 |
| H2A—C2—H2C | 109.5 | C15—C14—H14 | 120.4 |
| H2B—C2—H2C | 109.5 | N3—C15—C14 | 121.37 (17) |
| N1—C3—C5 | 110.28 (15) | N3—C15—C16 | 115.97 (15) |
| N1—C3—C4 | 111.39 (16) | C14—C15—C16 | 122.66 (16) |
| C5—C3—C4 | 112.32 (17) | N4—C16—C20 | 121.27 (17) |
| N1—C3—H3 | 107.5 | N4—C16—C15 | 116.02 (15) |
| C5—C3—H3 | 107.5 | C20—C16—C15 | 122.70 (16) |
| C4—C3—H3 | 107.5 | N4—C17—C18 | 122.76 (19) |
| C3—C4—H4A | 109.5 | N4—C17—H17 | 118.6 |
| C3—C4—H4B | 109.5 | C18—C17—H17 | 118.6 |
| H4A—C4—H4B | 109.5 | C19—C18—C17 | 118.32 (19) |
| C3—C4—H4C | 109.5 | C19—C18—H18 | 120.8 |
| H4A—C4—H4C | 109.5 | C17—C18—H18 | 120.8 |
| H4B—C4—H4C | 109.5 | C18—C19—C20 | 119.48 (19) |
| C3—C5—H5A | 109.5 | C18—C19—H19 | 120.3 |
| C3—C5—H5B | 109.5 | C20—C19—H19 | 120.3 |
| H5A—C5—H5B | 109.5 | C19—C20—C16 | 119.17 (19) |
| C3—C5—H5C | 109.5 | C19—C20—H20 | 120.4 |
| H5A—C5—H5C | 109.5 | C16—C20—H20 | 120.4 |
| H5B—C5—H5C | 109.5 | ||
| N3—Cd—S1—C1 | 72.53 (7) | Cd—S2—C1—S1 | −1.23 (9) |
| N4—Cd—S1—C1 | 133.16 (7) | Cd—S1—C1—N1 | −179.36 (14) |
| S4—Cd—S1—C1 | −70.74 (6) | Cd—S1—C1—S2 | 1.26 (9) |
| S3—Cd—S1—C1 | −135.51 (6) | C1—N1—C3—C5 | −100.74 (19) |
| S2—Cd—S1—C1 | −0.76 (6) | C2—N1—C3—C5 | 72.2 (2) |
| N3—Cd—S2—C1 | −123.88 (7) | C1—N1—C3—C4 | 133.84 (18) |
| N4—Cd—S2—C1 | −64.86 (7) | C2—N1—C3—C4 | −53.2 (2) |
| S1—Cd—S2—C1 | 0.76 (6) | C7—N2—C6—S3 | −2.8 (2) |
| S4—Cd—S2—C1 | 146.73 (6) | C8—N2—C6—S3 | −178.74 (14) |
| S3—Cd—S2—C1 | 80.51 (6) | C7—N2—C6—S4 | 177.74 (15) |
| N3—Cd—S3—C6 | −69.81 (7) | C8—N2—C6—S4 | 1.8 (2) |
| N4—Cd—S3—C6 | −130.23 (7) | Cd—S3—C6—N2 | −176.65 (14) |
| S1—Cd—S3—C6 | 143.09 (6) | Cd—S3—C6—S4 | 2.79 (9) |
| S4—Cd—S3—C6 | −1.72 (6) | Cd—S4—C6—N2 | 176.64 (14) |
| S2—Cd—S3—C6 | 76.43 (6) | Cd—S4—C6—S3 | −2.79 (9) |
| N3—Cd—S4—C6 | 138.13 (7) | C6—N2—C8—C10 | 106.5 (2) |
| N4—Cd—S4—C6 | 77.20 (7) | C7—N2—C8—C10 | −69.5 (2) |
| S1—Cd—S4—C6 | −72.77 (6) | C6—N2—C8—C9 | −128.48 (19) |
| S3—Cd—S4—C6 | 1.71 (6) | C7—N2—C8—C9 | 55.5 (2) |
| S2—Cd—S4—C6 | −133.59 (6) | C15—N3—C11—C12 | 0.9 (3) |
| N4—Cd—N3—C11 | 175.46 (15) | Cd—N3—C11—C12 | −175.40 (15) |
| S1—Cd—N3—C11 | −113.83 (13) | N3—C11—C12—C13 | −0.7 (3) |
| S4—Cd—N3—C11 | 45.48 (14) | C11—C12—C13—C14 | 0.0 (3) |
| S3—Cd—N3—C11 | 104.86 (14) | C12—C13—C14—C15 | 0.4 (3) |
| S2—Cd—N3—C11 | −51.79 (14) | C11—N3—C15—C14 | −0.4 (3) |
| N4—Cd—N3—C15 | −0.80 (12) | Cd—N3—C15—C14 | 175.94 (13) |
| S1—Cd—N3—C15 | 69.92 (13) | C11—N3—C15—C16 | −179.77 (16) |
| S4—Cd—N3—C15 | −130.78 (12) | Cd—N3—C15—C16 | −3.45 (19) |
| S3—Cd—N3—C15 | −71.39 (13) | C13—C14—C15—N3 | −0.3 (3) |
| S2—Cd—N3—C15 | 131.96 (12) | C13—C14—C15—C16 | 179.07 (17) |
| N3—Cd—N4—C16 | 5.64 (12) | C17—N4—C16—C20 | −0.5 (3) |
| S1—Cd—N4—C16 | −120.06 (12) | Cd—N4—C16—C20 | 169.56 (13) |
| S4—Cd—N4—C16 | 77.17 (13) | C17—N4—C16—C15 | −179.46 (15) |
| S3—Cd—N4—C16 | 141.13 (12) | Cd—N4—C16—C15 | −9.43 (19) |
| S2—Cd—N4—C16 | −62.79 (14) | N3—C15—C16—N4 | 8.4 (2) |
| N3—Cd—N4—C17 | 175.54 (15) | C14—C15—C16—N4 | −171.00 (16) |
| S1—Cd—N4—C17 | 49.84 (13) | N3—C15—C16—C20 | −170.60 (16) |
| S4—Cd—N4—C17 | −112.93 (13) | C14—C15—C16—C20 | 10.0 (3) |
| S3—Cd—N4—C17 | −48.97 (14) | C16—N4—C17—C18 | −0.1 (3) |
| S2—Cd—N4—C17 | 107.11 (13) | Cd—N4—C17—C18 | −170.09 (14) |
| C2—N1—C1—S2 | 7.9 (2) | N4—C17—C18—C19 | 0.6 (3) |
| C3—N1—C1—S2 | −179.35 (13) | C17—C18—C19—C20 | −0.5 (3) |
| C2—N1—C1—S1 | −171.46 (15) | C18—C19—C20—C16 | −0.1 (3) |
| C3—N1—C1—S1 | 1.3 (2) | N4—C16—C20—C19 | 0.5 (3) |
| Cd—S2—C1—N1 | 179.38 (14) | C15—C16—C20—C19 | 179.47 (18) |
| H··· | ||||
| C18—H18···S2i | 0.95 | 2.78 | 3.712 (2) | 167 |
Selected bond lengths (Å)
| Cd—S1 | 2.6463 (5) |
| Cd—S2 | 2.7128 (5) |
| Cd—S3 | 2.6518 (5) |
| Cd—S4 | 2.6490 (5) |
| Cd—N3 | 2.4122 (14) |
| Cd—N4 | 2.4191 (15) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| C18—H18⋯S2i | 0.95 | 2.78 | 3.712 (2) | 167 |
Symmetry code: (i) .