| Literature DB >> 21579049 |
Ji-Wen Cui, Xiao-Bing Cui, Hai-Hui Yu, Ji-Qing Xu, Shu-Hong Wang.
Abstract
In the title organic-inorganic hybrid vanadate complex, [Cu(2)V(6)O(17)(C(10)H(8)N(2))(4)](n), the Cu(II) atom is six-coordinated by two chelating 2,2'-bipyridine (bipy) ligands and two vanadate O atoms in a distorted octa-hedral geometry. Two [Cu(bipy)(2)V(3)O(8)] units are linked by a bridging O atom, which lies on an inversion center, forming a dimeric unit. The dimeric units are further connected by bridging vanadate O atoms into a two-dimensional layer parallel to (100). The layers are connected by weak C-H⋯O hydrogen bonds.Entities:
Year: 2010 PMID: 21579049 PMCID: PMC2979115 DOI: 10.1107/S1600536810014224
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Cu2V6O17(C10H8N2)4] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 7302 reflections |
| θ = 2.4–26.0° | |
| µ = 2.07 mm−1 | |
| β = 92.00 (3)° | Block, red |
| 0.57 × 0.40 × 0.30 mm | |
| Rigaku R-AXIS RAPID diffractometer | 4742 independent reflections |
| Radiation source: fine-focus sealed tube | 4010 reflections with |
| graphite | |
| Detector resolution: 10 pixels mm-1 | θmax = 26.1°, θmin = 2.4° |
| ω scans | |
| Absorption correction: multi-scan ( | |
| 20154 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 | |
| All H-atom parameters refined | |
| 4742 reflections | (Δ/σ)max = 0.001 |
| 395 parameters | Δρmax = 0.47 e Å−3 |
| 0 restraints | Δρmin = −0.67 e Å−3 |
| Cu1 | 0.23318 (2) | 0.97904 (2) | 0.20082 (3) | 0.02820 (11) | |
| V1 | 0.08531 (3) | 1.05781 (3) | 0.42475 (4) | 0.02542 (12) | |
| V2 | 0.31303 (3) | 1.19857 (3) | 0.31446 (4) | 0.02286 (12) | |
| V3 | 0.25041 (3) | 1.14320 (3) | 0.60425 (4) | 0.02692 (12) | |
| O1 | 0.14691 (13) | 0.98560 (13) | 0.3484 (2) | 0.0341 (5) | |
| O2 | 0.0000 | 1.0000 | 0.5000 | 0.0553 (10) | |
| O3 | 0.04662 (16) | 1.13047 (15) | 0.3236 (2) | 0.0510 (6) | |
| O4 | 0.27773 (15) | 1.10202 (14) | 0.2580 (2) | 0.0427 (5) | |
| O5 | 0.41332 (14) | 1.21072 (16) | 0.2836 (2) | 0.0436 (5) | |
| O6 | 0.25003 (15) | 1.28957 (15) | 0.2414 (2) | 0.0430 (5) | |
| O7 | 0.30503 (16) | 1.20006 (18) | 0.4860 (2) | 0.0510 (6) | |
| O8 | 0.14570 (16) | 1.12151 (18) | 0.5470 (2) | 0.0551 (7) | |
| O9 | 0.2978 (2) | 1.05097 (19) | 0.6372 (3) | 0.0846 (11) | |
| N1 | 0.17768 (16) | 0.86159 (15) | 0.1249 (2) | 0.0318 (5) | |
| N2 | 0.15122 (14) | 1.03192 (15) | 0.0616 (2) | 0.0268 (5) | |
| N3 | 0.32645 (15) | 0.91624 (15) | 0.3159 (2) | 0.0294 (5) | |
| N4 | 0.33465 (15) | 0.96215 (17) | 0.0718 (2) | 0.0318 (5) | |
| C1 | 0.1889 (2) | 0.7771 (2) | 0.1683 (3) | 0.0430 (8) | |
| C2 | 0.1533 (3) | 0.7026 (2) | 0.1050 (4) | 0.0546 (11) | |
| C3 | 0.1052 (3) | 0.7157 (2) | −0.0051 (4) | 0.0527 (10) | |
| C4 | 0.0924 (2) | 0.8026 (2) | −0.0504 (4) | 0.0437 (8) | |
| C5 | 0.12893 (18) | 0.87492 (19) | 0.0171 (3) | 0.0313 (6) | |
| C6 | 0.11711 (17) | 0.97065 (19) | −0.0214 (3) | 0.0292 (6) | |
| C7 | 0.0741 (2) | 0.9974 (3) | −0.1329 (3) | 0.0428 (8) | |
| C8 | 0.0654 (2) | 1.0887 (3) | −0.1598 (3) | 0.0453 (8) | |
| C9 | 0.0985 (2) | 1.1508 (2) | −0.0744 (3) | 0.0393 (7) | |
| C10 | 0.14073 (19) | 1.1201 (2) | 0.0355 (3) | 0.0333 (6) | |
| C11 | 0.3215 (2) | 0.9033 (2) | 0.4409 (3) | 0.0407 (7) | |
| C12 | 0.3903 (3) | 0.8710 (3) | 0.5148 (4) | 0.0550 (10) | |
| C13 | 0.4660 (3) | 0.8537 (3) | 0.4584 (4) | 0.0615 (12) | |
| C14 | 0.4726 (2) | 0.8668 (3) | 0.3293 (4) | 0.0498 (9) | |
| C15 | 0.40065 (19) | 0.8971 (2) | 0.2594 (3) | 0.0340 (7) | |
| C16 | 0.40090 (19) | 0.9128 (2) | 0.1201 (3) | 0.0343 (6) | |
| C17 | 0.4643 (2) | 0.8791 (3) | 0.0428 (4) | 0.0478 (9) | |
| C18 | 0.4617 (3) | 0.8992 (3) | −0.0851 (4) | 0.0562 (10) | |
| C19 | 0.3964 (2) | 0.9526 (3) | −0.1333 (3) | 0.0509 (9) | |
| C20 | 0.3348 (2) | 0.9822 (3) | −0.0522 (3) | 0.0409 (8) | |
| H1 | 0.299 (2) | 1.013 (2) | −0.078 (3) | 0.032 (9)* | |
| H2 | 0.387 (2) | 0.969 (3) | −0.223 (4) | 0.057 (11)* | |
| H3 | 0.508 (3) | 0.880 (2) | −0.129 (4) | 0.053 (11)* | |
| H4 | 0.498 (2) | 0.846 (3) | 0.078 (4) | 0.050 (11)* | |
| H5 | 0.522 (3) | 0.856 (2) | 0.292 (3) | 0.052 (11)* | |
| H6 | 0.510 (3) | 0.835 (3) | 0.498 (4) | 0.065 (12)* | |
| H7 | 0.384 (3) | 0.867 (3) | 0.598 (4) | 0.072 (13)* | |
| H8 | 0.272 (2) | 0.916 (2) | 0.474 (3) | 0.030 (8)* | |
| H9 | 0.1628 (19) | 1.159 (2) | 0.094 (3) | 0.026 (8)* | |
| H10 | 0.091 (2) | 1.207 (3) | −0.088 (3) | 0.052 (11)* | |
| H11 | 0.034 (3) | 1.110 (3) | −0.245 (4) | 0.070 (12)* | |
| H12 | 0.056 (2) | 0.956 (3) | −0.177 (4) | 0.050 (11)* | |
| H13 | 0.065 (3) | 0.813 (3) | −0.128 (4) | 0.072 (14)* | |
| H14 | 0.077 (3) | 0.658 (3) | −0.049 (4) | 0.077 (13)* | |
| H15 | 0.164 (3) | 0.651 (3) | 0.129 (4) | 0.060 (12)* | |
| H16 | 0.223 (2) | 0.772 (2) | 0.247 (3) | 0.040 (9)* |
| Cu1 | 0.02821 (19) | 0.02505 (19) | 0.0313 (2) | 0.00175 (13) | −0.00022 (14) | −0.00123 (13) |
| V1 | 0.0201 (2) | 0.0241 (2) | 0.0322 (3) | −0.00464 (17) | 0.00256 (18) | −0.00629 (18) |
| V2 | 0.0239 (2) | 0.0238 (2) | 0.0208 (2) | −0.00305 (17) | −0.00113 (17) | 0.00312 (17) |
| V3 | 0.0344 (3) | 0.0247 (2) | 0.0215 (2) | 0.00049 (19) | −0.00231 (19) | −0.00010 (18) |
| O1 | 0.0324 (11) | 0.0333 (11) | 0.0370 (11) | 0.0057 (9) | 0.0089 (9) | −0.0015 (9) |
| O2 | 0.0417 (19) | 0.0462 (19) | 0.080 (3) | −0.0205 (16) | 0.0305 (18) | −0.0156 (18) |
| O3 | 0.0606 (16) | 0.0355 (12) | 0.0561 (15) | 0.0119 (11) | −0.0094 (12) | −0.0029 (11) |
| O4 | 0.0535 (14) | 0.0283 (11) | 0.0450 (13) | −0.0079 (10) | −0.0142 (11) | −0.0008 (9) |
| O5 | 0.0289 (11) | 0.0584 (15) | 0.0438 (13) | −0.0057 (10) | 0.0052 (9) | 0.0031 (11) |
| O6 | 0.0523 (14) | 0.0443 (13) | 0.0329 (11) | 0.0190 (11) | 0.0073 (10) | 0.0107 (10) |
| O7 | 0.0553 (15) | 0.0756 (17) | 0.0221 (11) | −0.0188 (13) | 0.0007 (10) | 0.0027 (11) |
| O8 | 0.0452 (14) | 0.0773 (18) | 0.0430 (14) | −0.0242 (13) | 0.0016 (11) | −0.0233 (12) |
| O9 | 0.140 (3) | 0.0501 (16) | 0.0618 (18) | 0.0471 (18) | −0.0262 (19) | −0.0005 (14) |
| N1 | 0.0354 (14) | 0.0246 (12) | 0.0361 (14) | −0.0028 (10) | 0.0089 (11) | −0.0038 (10) |
| N2 | 0.0231 (12) | 0.0260 (12) | 0.0312 (12) | 0.0005 (9) | −0.0015 (9) | −0.0020 (9) |
| N3 | 0.0325 (13) | 0.0271 (12) | 0.0286 (12) | 0.0054 (10) | −0.0012 (10) | −0.0004 (9) |
| N4 | 0.0277 (13) | 0.0359 (13) | 0.0317 (13) | 0.0023 (10) | 0.0020 (10) | 0.0009 (10) |
| C1 | 0.053 (2) | 0.0291 (16) | 0.047 (2) | −0.0013 (14) | 0.0123 (17) | −0.0002 (14) |
| C2 | 0.074 (3) | 0.0237 (17) | 0.068 (3) | −0.0073 (17) | 0.027 (2) | −0.0034 (16) |
| C3 | 0.060 (2) | 0.0374 (19) | 0.061 (2) | −0.0164 (17) | 0.0191 (19) | −0.0196 (17) |
| C4 | 0.0414 (19) | 0.0415 (19) | 0.048 (2) | −0.0090 (15) | 0.0062 (16) | −0.0190 (15) |
| C5 | 0.0275 (15) | 0.0319 (15) | 0.0350 (16) | −0.0018 (12) | 0.0076 (12) | −0.0102 (12) |
| C6 | 0.0220 (13) | 0.0353 (15) | 0.0303 (15) | −0.0013 (11) | 0.0019 (11) | −0.0073 (12) |
| C7 | 0.0378 (18) | 0.055 (2) | 0.0354 (18) | −0.0037 (16) | −0.0039 (14) | −0.0108 (16) |
| C8 | 0.0395 (19) | 0.059 (2) | 0.0368 (18) | 0.0058 (16) | −0.0055 (14) | 0.0090 (16) |
| C9 | 0.0369 (18) | 0.0387 (18) | 0.0423 (18) | 0.0035 (14) | 0.0011 (14) | 0.0102 (14) |
| C10 | 0.0311 (16) | 0.0285 (15) | 0.0399 (17) | 0.0003 (12) | −0.0034 (13) | 0.0004 (13) |
| C11 | 0.047 (2) | 0.0427 (18) | 0.0322 (17) | 0.0091 (15) | −0.0002 (15) | −0.0034 (14) |
| C12 | 0.076 (3) | 0.056 (2) | 0.0317 (19) | 0.014 (2) | −0.0137 (18) | 0.0014 (16) |
| C13 | 0.060 (3) | 0.067 (3) | 0.055 (2) | 0.025 (2) | −0.026 (2) | −0.0006 (19) |
| C14 | 0.039 (2) | 0.056 (2) | 0.054 (2) | 0.0190 (17) | −0.0066 (17) | −0.0005 (17) |
| C15 | 0.0329 (16) | 0.0292 (15) | 0.0397 (17) | 0.0067 (12) | −0.0023 (13) | −0.0009 (12) |
| C16 | 0.0293 (15) | 0.0335 (15) | 0.0401 (17) | 0.0057 (12) | 0.0023 (13) | 0.0003 (13) |
| C17 | 0.042 (2) | 0.050 (2) | 0.052 (2) | 0.0176 (17) | 0.0068 (17) | −0.0025 (17) |
| C18 | 0.057 (2) | 0.063 (2) | 0.050 (2) | 0.0111 (19) | 0.0220 (19) | −0.0076 (18) |
| C19 | 0.054 (2) | 0.065 (2) | 0.0344 (19) | 0.0032 (18) | 0.0077 (16) | 0.0014 (17) |
| C20 | 0.0333 (18) | 0.053 (2) | 0.0360 (18) | 0.0042 (16) | −0.0004 (14) | 0.0054 (15) |
| Cu1—O4 | 2.025 (2) | C2—H15 | 0.82 (4) |
| Cu1—N2 | 2.055 (2) | C3—C4 | 1.380 (5) |
| Cu1—N3 | 2.069 (2) | C3—H14 | 1.06 (4) |
| Cu1—N1 | 2.081 (2) | C4—C5 | 1.390 (4) |
| Cu1—O1 | 2.082 (2) | C4—H13 | 0.91 (4) |
| Cu1—N4 | 2.125 (2) | C5—C6 | 1.479 (4) |
| V1—O3 | 1.609 (2) | C6—C7 | 1.382 (5) |
| V1—O1 | 1.656 (2) | C7—C8 | 1.382 (5) |
| V1—O2 | 1.7813 (6) | C7—H12 | 0.82 (4) |
| V1—O8 | 1.821 (2) | C8—C9 | 1.367 (5) |
| V2—O5 | 1.610 (2) | C8—H11 | 1.05 (4) |
| V2—O4 | 1.630 (2) | C9—C10 | 1.380 (4) |
| V2—O7 | 1.805 (2) | C9—H10 | 0.85 (4) |
| V2—O6 | 1.814 (2) | C10—H9 | 0.90 (3) |
| V3—O9 | 1.580 (3) | C11—C12 | 1.381 (5) |
| V3—O7 | 1.740 (2) | C11—H8 | 0.87 (3) |
| V3—O8 | 1.741 (2) | C12—C13 | 1.358 (6) |
| V3—O6i | 1.746 (2) | C12—H7 | 0.88 (4) |
| O2—V1ii | 1.7813 (6) | C13—C14 | 1.373 (6) |
| O6—V3iii | 1.746 (2) | C13—H6 | 0.83 (4) |
| N1—C1 | 1.336 (4) | C14—C15 | 1.388 (4) |
| N1—C5 | 1.351 (4) | C14—H5 | 0.89 (4) |
| N2—C10 | 1.338 (4) | C15—C16 | 1.477 (4) |
| N2—C6 | 1.349 (3) | C16—C17 | 1.387 (4) |
| N3—C11 | 1.328 (4) | C17—C18 | 1.370 (5) |
| N3—C15 | 1.342 (4) | C17—H4 | 0.79 (4) |
| N4—C20 | 1.332 (4) | C18—C19 | 1.366 (5) |
| N4—C16 | 1.344 (4) | C18—H3 | 0.90 (4) |
| C1—C2 | 1.389 (5) | C19—C20 | 1.372 (5) |
| C1—H16 | 0.97 (3) | C19—H2 | 0.98 (4) |
| C2—C3 | 1.365 (6) | C20—H1 | 0.77 (3) |
| O4—Cu1—N2 | 93.75 (9) | C1—C2—H15 | 121 (3) |
| O4—Cu1—N3 | 90.30 (9) | C2—C3—C4 | 119.3 (3) |
| N2—Cu1—N3 | 170.39 (9) | C2—C3—H14 | 117 (2) |
| O4—Cu1—N1 | 172.68 (9) | C4—C3—H14 | 123 (2) |
| N2—Cu1—N1 | 78.93 (10) | C3—C4—C5 | 119.2 (4) |
| N3—Cu1—N1 | 96.93 (10) | C3—C4—H13 | 121 (3) |
| O4—Cu1—O1 | 87.74 (9) | C5—C4—H13 | 120 (3) |
| N2—Cu1—O1 | 96.38 (9) | N1—C5—C4 | 121.3 (3) |
| N3—Cu1—O1 | 92.48 (9) | N1—C5—C6 | 115.3 (2) |
| N1—Cu1—O1 | 93.10 (9) | C4—C5—C6 | 123.4 (3) |
| O4—Cu1—N4 | 92.31 (10) | N2—C6—C7 | 121.3 (3) |
| N2—Cu1—N4 | 92.71 (9) | N2—C6—C5 | 115.0 (2) |
| N3—Cu1—N4 | 78.41 (9) | C7—C6—C5 | 123.7 (3) |
| N1—Cu1—N4 | 88.01 (9) | C6—C7—C8 | 119.5 (3) |
| O1—Cu1—N4 | 170.89 (9) | C6—C7—H12 | 114 (3) |
| O3—V1—O1 | 108.66 (12) | C8—C7—H12 | 126 (3) |
| O3—V1—O2 | 110.17 (10) | C9—C8—C7 | 119.2 (3) |
| O1—V1—O2 | 110.81 (8) | C9—C8—H11 | 120 (2) |
| O3—V1—O8 | 106.82 (13) | C7—C8—H11 | 121 (2) |
| O1—V1—O8 | 112.34 (12) | C8—C9—C10 | 118.8 (3) |
| O2—V1—O8 | 107.96 (8) | C8—C9—H10 | 120 (3) |
| O5—V2—O4 | 109.82 (12) | C10—C9—H10 | 121 (3) |
| O5—V2—O7 | 107.40 (12) | N2—C10—C9 | 122.7 (3) |
| O4—V2—O7 | 109.75 (11) | N2—C10—H9 | 116.5 (19) |
| O5—V2—O6 | 110.05 (11) | C9—C10—H9 | 120.8 (19) |
| O4—V2—O6 | 108.97 (11) | N3—C11—C12 | 122.1 (3) |
| O7—V2—O6 | 110.83 (11) | N3—C11—H8 | 116 (2) |
| O9—V3—O7 | 109.65 (17) | C12—C11—H8 | 122 (2) |
| O9—V3—O8 | 109.78 (17) | C13—C12—C11 | 119.0 (4) |
| O7—V3—O8 | 108.38 (12) | C13—C12—H7 | 123 (3) |
| O9—V3—O6i | 108.97 (14) | C11—C12—H7 | 118 (3) |
| O7—V3—O6i | 109.07 (11) | C12—C13—C14 | 119.9 (3) |
| O8—V3—O6i | 110.97 (12) | C12—C13—H6 | 124 (3) |
| V1—O1—Cu1 | 141.73 (12) | C14—C13—H6 | 116 (3) |
| V1ii—O2—V1 | 180.00 (3) | C13—C14—C15 | 118.6 (4) |
| V2—O4—Cu1 | 175.90 (14) | C13—C14—H5 | 120 (2) |
| V3iii—O6—V2 | 138.61 (13) | C15—C14—H5 | 121 (2) |
| V3—O7—V2 | 138.95 (15) | N3—C15—C14 | 121.5 (3) |
| V3—O8—V1 | 141.98 (16) | N3—C15—C16 | 115.7 (3) |
| C1—N1—C5 | 118.9 (3) | C14—C15—C16 | 122.8 (3) |
| C1—N1—Cu1 | 126.9 (2) | N4—C16—C17 | 121.5 (3) |
| C5—N1—Cu1 | 114.19 (18) | N4—C16—C15 | 115.3 (3) |
| C10—N2—C6 | 118.6 (3) | C17—C16—C15 | 123.1 (3) |
| C10—N2—Cu1 | 125.6 (2) | C18—C17—C16 | 119.7 (3) |
| C6—N2—Cu1 | 114.90 (18) | C18—C17—H4 | 125 (3) |
| C11—N3—C15 | 119.0 (3) | C16—C17—H4 | 115 (3) |
| C11—N3—Cu1 | 125.1 (2) | C19—C18—C17 | 118.8 (3) |
| C15—N3—Cu1 | 115.52 (19) | C19—C18—H3 | 125 (2) |
| C20—N4—C16 | 117.4 (3) | C17—C18—H3 | 115 (2) |
| C20—N4—Cu1 | 128.3 (2) | C18—C19—C20 | 118.6 (3) |
| C16—N4—Cu1 | 113.47 (19) | C18—C19—H2 | 126 (2) |
| N1—C1—C2 | 122.1 (4) | C20—C19—H2 | 115 (2) |
| N1—C1—H16 | 116 (2) | N4—C20—C19 | 123.9 (3) |
| C2—C1—H16 | 122 (2) | N4—C20—H1 | 117 (3) |
| C3—C2—C1 | 119.2 (4) | C19—C20—H1 | 119 (3) |
| C3—C2—H15 | 119 (3) | ||
| O3—V1—O1—Cu1 | 36.1 (2) | N1—Cu1—N4—C16 | −90.4 (2) |
| O2—V1—O1—Cu1 | 157.26 (16) | C5—N1—C1—C2 | 1.1 (5) |
| O8—V1—O1—Cu1 | −81.9 (2) | Cu1—N1—C1—C2 | −175.5 (3) |
| O4—Cu1—O1—V1 | 37.4 (2) | N1—C1—C2—C3 | 0.0 (6) |
| N2—Cu1—O1—V1 | −56.2 (2) | C1—C2—C3—C4 | −0.6 (6) |
| N3—Cu1—O1—V1 | 127.6 (2) | C2—C3—C4—C5 | 0.1 (5) |
| N1—Cu1—O1—V1 | −135.4 (2) | C1—N1—C5—C4 | −1.6 (4) |
| O5—V2—O6—V3iii | 33.7 (3) | Cu1—N1—C5—C4 | 175.4 (2) |
| O4—V2—O6—V3iii | −86.8 (2) | C1—N1—C5—C6 | 177.8 (3) |
| O7—V2—O6—V3iii | 152.3 (2) | Cu1—N1—C5—C6 | −5.3 (3) |
| O9—V3—O7—V2 | 81.2 (3) | C3—C4—C5—N1 | 1.0 (5) |
| O8—V3—O7—V2 | −38.6 (3) | C3—C4—C5—C6 | −178.3 (3) |
| O6i—V3—O7—V2 | −159.5 (2) | C10—N2—C6—C7 | 1.7 (4) |
| O5—V2—O7—V3 | −138.5 (2) | Cu1—N2—C6—C7 | −167.8 (2) |
| O4—V2—O7—V3 | −19.1 (3) | C10—N2—C6—C5 | −177.9 (2) |
| O6—V2—O7—V3 | 101.3 (3) | Cu1—N2—C6—C5 | 12.6 (3) |
| O9—V3—O8—V1 | −54.8 (3) | N1—C5—C6—N2 | −4.8 (4) |
| O7—V3—O8—V1 | 64.9 (3) | C4—C5—C6—N2 | 174.6 (3) |
| O6i—V3—O8—V1 | −175.4 (2) | N1—C5—C6—C7 | 175.7 (3) |
| O3—V1—O8—V3 | −109.6 (3) | C4—C5—C6—C7 | −5.0 (5) |
| O1—V1—O8—V3 | 9.4 (3) | N2—C6—C7—C8 | −0.4 (5) |
| O2—V1—O8—V3 | 131.9 (2) | C5—C6—C7—C8 | 179.1 (3) |
| N2—Cu1—N1—C1 | −174.2 (3) | C6—C7—C8—C9 | −0.9 (5) |
| N3—Cu1—N1—C1 | 14.6 (3) | C7—C8—C9—C10 | 0.8 (5) |
| O1—Cu1—N1—C1 | −78.3 (3) | C6—N2—C10—C9 | −1.8 (4) |
| N4—Cu1—N1—C1 | 92.6 (3) | Cu1—N2—C10—C9 | 166.5 (2) |
| N2—Cu1—N1—C5 | 9.10 (19) | C8—C9—C10—N2 | 0.6 (5) |
| N3—Cu1—N1—C5 | −162.12 (19) | C15—N3—C11—C12 | 0.1 (5) |
| O1—Cu1—N1—C5 | 105.0 (2) | Cu1—N3—C11—C12 | −171.9 (3) |
| N4—Cu1—N1—C5 | −84.0 (2) | N3—C11—C12—C13 | 1.4 (6) |
| O4—Cu1—N2—C10 | −0.6 (2) | C11—C12—C13—C14 | −1.2 (6) |
| N1—Cu1—N2—C10 | 179.4 (3) | C12—C13—C14—C15 | −0.4 (6) |
| O1—Cu1—N2—C10 | 87.5 (2) | C11—N3—C15—C14 | −1.9 (5) |
| N4—Cu1—N2—C10 | −93.1 (2) | Cu1—N3—C15—C14 | 170.9 (3) |
| O4—Cu1—N2—C6 | 168.1 (2) | C11—N3—C15—C16 | 179.7 (3) |
| N1—Cu1—N2—C6 | −11.84 (19) | Cu1—N3—C15—C16 | −7.5 (3) |
| O1—Cu1—N2—C6 | −103.8 (2) | C13—C14—C15—N3 | 2.0 (5) |
| N4—Cu1—N2—C6 | 75.6 (2) | C13—C14—C15—C16 | −179.6 (3) |
| O4—Cu1—N3—C11 | 80.5 (3) | C20—N4—C16—C17 | −3.9 (5) |
| N1—Cu1—N3—C11 | −100.6 (3) | Cu1—N4—C16—C17 | 166.7 (3) |
| O1—Cu1—N3—C11 | −7.2 (3) | C20—N4—C16—C15 | 176.4 (3) |
| N4—Cu1—N3—C11 | 172.8 (3) | Cu1—N4—C16—C15 | −13.0 (3) |
| O4—Cu1—N3—C15 | −91.7 (2) | N3—C15—C16—N4 | 13.9 (4) |
| N1—Cu1—N3—C15 | 87.1 (2) | C14—C15—C16—N4 | −164.5 (3) |
| O1—Cu1—N3—C15 | −179.5 (2) | N3—C15—C16—C17 | −165.8 (3) |
| N4—Cu1—N3—C15 | 0.6 (2) | C14—C15—C16—C17 | 15.8 (5) |
| O4—Cu1—N4—C20 | −93.8 (3) | N4—C16—C17—C18 | 2.6 (5) |
| N2—Cu1—N4—C20 | 0.1 (3) | C15—C16—C17—C18 | −177.8 (3) |
| N3—Cu1—N4—C20 | 176.4 (3) | C16—C17—C18—C19 | 0.2 (6) |
| N1—Cu1—N4—C20 | 78.9 (3) | C17—C18—C19—C20 | −1.5 (6) |
| O4—Cu1—N4—C16 | 96.9 (2) | C16—N4—C20—C19 | 2.6 (5) |
| N2—Cu1—N4—C16 | −169.2 (2) | Cu1—N4—C20—C19 | −166.4 (3) |
| N3—Cu1—N4—C16 | 7.1 (2) | C18—C19—C20—N4 | 0.1 (6) |
| H··· | ||||
| C11—H8···O1 | 0.87 (3) | 2.52 (3) | 3.093 (4) | 124 (2) |
| C14—H5···O5iv | 0.89 (4) | 2.51 (3) | 3.159 (5) | 131 (3) |
| C18—H3···O5v | 0.90 (4) | 2.46 (4) | 3.315 (5) | 157 (3) |
| C19—H2···O9vi | 0.98 (4) | 2.32 (4) | 3.156 (5) | 144 (3) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| C11—H8⋯O1 | 0.87 (3) | 2.52 (3) | 3.093 (4) | 124 (2) |
| C14—H5⋯O5i | 0.89 (4) | 2.51 (3) | 3.159 (5) | 131 (3) |
| C18—H3⋯O5ii | 0.90 (4) | 2.46 (4) | 3.315 (5) | 157 (3) |
| C19—H2⋯O9iii | 0.98 (4) | 2.32 (4) | 3.156 (5) | 144 (3) |
Symmetry codes: (i) ; (ii) ; (iii) .