| Literature DB >> 21587377 |
Meng Su, Zhan-Dong Huang, Huang Sun, Guang Yang, Seik Weng Ng.
Abstract
In the polymeric title compound, [Co(2)(C(3)H(7)NO)(3)(C(8)H(3)NO(6))(2)]·C(3)H(7)NO, one 5-nitro-isophthalate dianion has its two carboxyl-ate groups chelating to one Co(II) atom while simultaneously coordinating to another metal atom in a μ(4)-bridging mode. The other 5-nitro-isophthalte dianion has one carboxyl-ate group chelating to a metal atom whereas the other bridges two metal atoms in a μ(3)-bridging mode. Both metal atoms show an octa-hedral coordination. The polymer adopts a layer motif, with the lattice dimethyl-formamide mol-ecules occupying the space between adjacent layers.Entities:
Year: 2010 PMID: 21587377 PMCID: PMC2983205 DOI: 10.1107/S1600536810035270
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Co2(C3H7NO)3(C8H3NO6)2]·C3H7NO | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 1014 reflections |
| θ = 2.3–26.7° | |
| µ = 0.99 mm−1 | |
| β = 92.910 (2)° | Block, purple |
| 0.40 × 0.30 × 0.30 mm | |
| Bruker SMART diffractometer | 7876 independent reflections |
| Radiation source: fine-focus sealed tube | 5128 reflections with |
| graphite | |
| ω scans | θmax = 27.0°, θmin = 2.0° |
| Absorption correction: multi-scan ( | |
| 21143 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 | |
| 7876 reflections | (Δ/σ)max = 0.001 |
| 477 parameters | Δρmax = 0.57 e Å−3 |
| 54 restraints | Δρmin = −0.45 e Å−3 |
| Co1 | 0.54070 (4) | 0.62850 (2) | 0.36883 (2) | 0.03535 (14) | |
| Co2 | 0.75875 (4) | 0.69413 (2) | 0.25276 (2) | 0.03577 (14) | |
| O1 | 0.7161 (2) | 0.61369 (15) | 0.41609 (12) | 0.0509 (6) | |
| O2 | 0.8391 (2) | 0.65261 (16) | 0.33703 (12) | 0.0536 (7) | |
| O3 | 1.3188 (2) | 0.63449 (18) | 0.35333 (13) | 0.0615 (8) | |
| O4 | 1.4234 (2) | 0.60440 (14) | 0.44350 (11) | 0.0452 (6) | |
| O5 | 1.1571 (3) | 0.5635 (2) | 0.63158 (14) | 0.0841 (10) | |
| O6 | 0.9466 (3) | 0.5792 (2) | 0.62357 (14) | 0.0890 (11) | |
| O7 | 0.5916 (2) | 0.62286 (13) | 0.25975 (14) | 0.0584 (7) | |
| O8 | 0.5266 (3) | 0.52567 (16) | 0.31596 (14) | 0.0641 (8) | |
| O9 | 0.3476 (2) | 0.28716 (13) | 0.21118 (12) | 0.0447 (6) | |
| O10 | 0.4601 (3) | 0.24599 (14) | 0.12880 (13) | 0.0548 (7) | |
| O11 | 0.6418 (4) | 0.4515 (2) | −0.00474 (17) | 0.0982 (12) | |
| O12 | 0.7008 (6) | 0.5587 (3) | 0.0369 (2) | 0.160 (2) | |
| O13 | 0.8704 (3) | 0.60593 (15) | 0.20713 (13) | 0.0634 (8) | |
| O14 | 0.9230 (3) | 0.76957 (15) | 0.25177 (13) | 0.0619 (7) | |
| O15 | 0.6900 (3) | 0.72766 (15) | 0.16294 (12) | 0.0599 (7) | |
| O16 | 1.0622 (10) | 0.7746 (4) | 0.5743 (4) | 0.236 (4) | |
| N1 | 1.0547 (3) | 0.5774 (2) | 0.60062 (15) | 0.0565 (8) | |
| N2 | 0.6509 (4) | 0.4948 (3) | 0.03991 (19) | 0.0781 (11) | |
| N3 | 1.0517 (3) | 0.53017 (18) | 0.20161 (17) | 0.0715 (11) | |
| N4 | 1.1460 (3) | 0.7832 (2) | 0.24308 (18) | 0.0788 (11) | |
| N5 | 0.6043 (3) | 0.82156 (18) | 0.09718 (13) | 0.0572 (9) | |
| N6 | 0.9621 (7) | 0.8134 (3) | 0.4885 (3) | 0.1170 (18) | |
| C1 | 0.8239 (3) | 0.62893 (19) | 0.39168 (17) | 0.0385 (8) | |
| C2 | 0.9490 (3) | 0.61717 (18) | 0.43297 (16) | 0.0361 (7) | |
| C3 | 1.0713 (3) | 0.62258 (19) | 0.40590 (16) | 0.0390 (8) | |
| H3 | 1.0752 | 0.6346 | 0.3630 | 0.047* | |
| C4 | 1.1879 (3) | 0.6102 (2) | 0.44235 (16) | 0.0381 (8) | |
| C5 | 1.1835 (3) | 0.5940 (2) | 0.50582 (16) | 0.0411 (8) | |
| H5 | 1.2612 | 0.5851 | 0.5305 | 0.049* | |
| C6 | 1.0611 (3) | 0.5913 (2) | 0.53248 (16) | 0.0399 (8) | |
| C7 | 0.9434 (3) | 0.60096 (19) | 0.49684 (16) | 0.0394 (8) | |
| H7 | 0.8621 | 0.5966 | 0.5155 | 0.047* | |
| C8 | 1.3176 (3) | 0.6162 (2) | 0.41043 (18) | 0.0411 (8) | |
| C9 | 0.5582 (3) | 0.5522 (2) | 0.2641 (2) | 0.0454 (9) | |
| C10 | 0.5511 (3) | 0.50093 (19) | 0.20667 (17) | 0.0400 (8) | |
| C11 | 0.4916 (3) | 0.42749 (18) | 0.21119 (16) | 0.0389 (8) | |
| H11 | 0.4562 | 0.4127 | 0.2493 | 0.047* | |
| C12 | 0.4843 (3) | 0.37624 (18) | 0.16031 (16) | 0.0374 (7) | |
| C13 | 0.5376 (3) | 0.3984 (2) | 0.10396 (17) | 0.0458 (9) | |
| H13 | 0.5358 | 0.3646 | 0.0694 | 0.055* | |
| C14 | 0.5937 (4) | 0.4717 (2) | 0.10006 (18) | 0.0525 (10) | |
| C15 | 0.6007 (4) | 0.5237 (2) | 0.15018 (18) | 0.0509 (9) | |
| H15 | 0.6382 | 0.5730 | 0.1458 | 0.061* | |
| C16 | 0.4250 (3) | 0.29629 (19) | 0.16771 (17) | 0.0391 (8) | |
| C17 | 0.9538 (4) | 0.5620 (2) | 0.2306 (2) | 0.0616 (11) | |
| H17 | 0.9474 | 0.5499 | 0.2734 | 0.074* | |
| C18 | 1.0674 (8) | 0.5465 (4) | 0.1361 (3) | 0.180 (4) | |
| H18A | 1.0040 | 0.5855 | 0.1219 | 0.269* | |
| H18B | 1.0532 | 0.4996 | 0.1117 | 0.269* | |
| H18C | 1.1556 | 0.5656 | 0.1306 | 0.269* | |
| C19 | 1.1493 (5) | 0.4793 (3) | 0.2333 (3) | 0.132 (3) | |
| H19A | 1.1219 | 0.4670 | 0.2751 | 0.198* | |
| H19B | 1.2337 | 0.5054 | 0.2365 | 0.198* | |
| H19C | 1.1569 | 0.4319 | 0.2092 | 0.198* | |
| C20 | 1.0260 (4) | 0.7575 (2) | 0.2246 (2) | 0.0653 (11) | |
| H20 | 1.0193 | 0.7276 | 0.1877 | 0.078* | |
| C21 | 1.1625 (6) | 0.8289 (5) | 0.2992 (3) | 0.167 (4) | |
| H21A | 1.0866 | 0.8224 | 0.3244 | 0.250* | |
| H21B | 1.1710 | 0.8831 | 0.2880 | 0.250* | |
| H21C | 1.2409 | 0.8123 | 0.3232 | 0.250* | |
| C22 | 1.2638 (5) | 0.7666 (4) | 0.2097 (3) | 0.123 (2) | |
| H22A | 1.2399 | 0.7391 | 0.1711 | 0.184* | |
| H22B | 1.3228 | 0.7349 | 0.2360 | 0.184* | |
| H22C | 1.3071 | 0.8148 | 0.1999 | 0.184* | |
| C23 | 0.6784 (3) | 0.7969 (2) | 0.14649 (15) | 0.0503 (9) | |
| H23 | 0.7252 | 0.8342 | 0.1707 | 0.060* | |
| C24 | 0.5276 (6) | 0.7661 (3) | 0.0572 (2) | 0.099 (2) | |
| H24A | 0.5459 | 0.7138 | 0.0716 | 0.149* | |
| H24B | 0.5520 | 0.7713 | 0.0139 | 0.149* | |
| H24C | 0.4346 | 0.7769 | 0.0597 | 0.149* | |
| C25 | 0.5940 (4) | 0.9038 (2) | 0.08090 (19) | 0.0641 (11) | |
| H25A | 0.6564 | 0.9332 | 0.1073 | 0.096* | |
| H25B | 0.5056 | 0.9218 | 0.0875 | 0.096* | |
| H25C | 0.6132 | 0.9108 | 0.0371 | 0.096* | |
| C26 | 0.9403 (11) | 0.7817 (4) | 0.5443 (5) | 0.175 (4) | |
| H26 | 0.8589 | 0.7673 | 0.5596 | 0.210* | |
| C27 | 1.0928 (11) | 0.8320 (7) | 0.4728 (6) | 0.267 (6) | |
| H27A | 1.1542 | 0.8143 | 0.5061 | 0.400* | |
| H27B | 1.1009 | 0.8876 | 0.4680 | 0.400* | |
| H27C | 1.1123 | 0.8066 | 0.4337 | 0.400* | |
| C28 | 0.8669 (10) | 0.8325 (5) | 0.4374 (4) | 0.176 (4) | |
| H28A | 0.7826 | 0.8096 | 0.4456 | 0.265* | |
| H28B | 0.8972 | 0.8124 | 0.3981 | 0.265* | |
| H28C | 0.8577 | 0.8884 | 0.4344 | 0.265* |
| Co1 | 0.0234 (2) | 0.0368 (2) | 0.0459 (3) | −0.00044 (18) | 0.00267 (17) | 0.0023 (2) |
| Co2 | 0.0301 (2) | 0.0324 (2) | 0.0445 (3) | 0.00062 (18) | −0.00140 (18) | 0.00308 (19) |
| O1 | 0.0218 (12) | 0.0657 (16) | 0.0653 (17) | −0.0010 (11) | 0.0021 (11) | 0.0089 (13) |
| O2 | 0.0333 (14) | 0.0776 (18) | 0.0495 (16) | 0.0072 (13) | −0.0015 (11) | 0.0134 (14) |
| O3 | 0.0308 (14) | 0.105 (2) | 0.0496 (17) | −0.0015 (14) | 0.0063 (11) | 0.0135 (15) |
| O4 | 0.0236 (12) | 0.0602 (15) | 0.0515 (15) | 0.0024 (11) | 0.0001 (10) | 0.0052 (12) |
| O5 | 0.073 (2) | 0.128 (3) | 0.0500 (18) | 0.019 (2) | −0.0080 (15) | 0.0166 (18) |
| O6 | 0.066 (2) | 0.144 (3) | 0.059 (2) | 0.004 (2) | 0.0244 (16) | 0.0161 (19) |
| O7 | 0.0414 (15) | 0.0348 (13) | 0.098 (2) | −0.0069 (11) | −0.0058 (14) | −0.0051 (13) |
| O8 | 0.075 (2) | 0.0554 (17) | 0.0625 (19) | −0.0133 (15) | 0.0114 (15) | −0.0148 (14) |
| O9 | 0.0435 (14) | 0.0315 (12) | 0.0598 (16) | −0.0068 (10) | 0.0106 (12) | −0.0034 (11) |
| O10 | 0.0599 (17) | 0.0379 (14) | 0.0683 (18) | −0.0077 (12) | 0.0183 (13) | −0.0083 (13) |
| O11 | 0.128 (3) | 0.104 (3) | 0.066 (2) | −0.006 (2) | 0.035 (2) | 0.008 (2) |
| O12 | 0.243 (6) | 0.148 (4) | 0.096 (3) | −0.123 (4) | 0.055 (3) | 0.006 (3) |
| O13 | 0.0591 (18) | 0.0579 (16) | 0.0722 (19) | 0.0208 (14) | −0.0057 (14) | −0.0053 (14) |
| O14 | 0.0412 (15) | 0.0610 (17) | 0.085 (2) | −0.0156 (13) | 0.0186 (14) | −0.0011 (15) |
| O15 | 0.080 (2) | 0.0464 (15) | 0.0516 (16) | 0.0092 (14) | −0.0116 (14) | 0.0047 (13) |
| O16 | 0.329 (8) | 0.147 (5) | 0.223 (6) | 0.002 (6) | −0.068 (6) | −0.057 (5) |
| N1 | 0.054 (2) | 0.070 (2) | 0.046 (2) | 0.0064 (17) | 0.0045 (17) | 0.0046 (16) |
| N2 | 0.087 (3) | 0.089 (3) | 0.059 (3) | −0.026 (2) | 0.013 (2) | 0.011 (2) |
| N3 | 0.072 (3) | 0.068 (2) | 0.077 (3) | 0.031 (2) | 0.028 (2) | 0.009 (2) |
| N4 | 0.045 (2) | 0.097 (3) | 0.095 (3) | −0.014 (2) | 0.008 (2) | 0.003 (2) |
| N5 | 0.067 (2) | 0.0534 (19) | 0.0494 (19) | 0.0082 (17) | −0.0100 (16) | 0.0036 (15) |
| N6 | 0.134 (5) | 0.098 (4) | 0.120 (4) | −0.012 (3) | 0.020 (4) | −0.034 (3) |
| C1 | 0.0256 (17) | 0.0405 (18) | 0.049 (2) | 0.0047 (14) | 0.0006 (14) | 0.0002 (16) |
| C2 | 0.0226 (15) | 0.0384 (17) | 0.047 (2) | 0.0009 (13) | 0.0020 (13) | 0.0032 (15) |
| C3 | 0.0296 (17) | 0.0478 (19) | 0.0393 (19) | −0.0016 (15) | 0.0001 (14) | 0.0044 (15) |
| C4 | 0.0255 (16) | 0.0474 (19) | 0.041 (2) | −0.0011 (14) | 0.0003 (13) | 0.0005 (15) |
| C5 | 0.0293 (17) | 0.0479 (19) | 0.046 (2) | 0.0005 (15) | −0.0047 (14) | −0.0006 (16) |
| C6 | 0.0349 (18) | 0.0449 (19) | 0.0397 (19) | 0.0038 (15) | 0.0018 (14) | 0.0041 (15) |
| C7 | 0.0262 (17) | 0.0438 (18) | 0.049 (2) | 0.0032 (14) | 0.0089 (14) | 0.0034 (16) |
| C8 | 0.0228 (17) | 0.049 (2) | 0.052 (2) | −0.0035 (14) | 0.0025 (15) | 0.0001 (17) |
| C9 | 0.0286 (18) | 0.038 (2) | 0.069 (3) | −0.0006 (15) | −0.0030 (17) | −0.0078 (18) |
| C10 | 0.0320 (18) | 0.0347 (17) | 0.053 (2) | −0.0024 (14) | 0.0014 (15) | 0.0011 (16) |
| C11 | 0.0298 (17) | 0.0367 (18) | 0.050 (2) | −0.0007 (14) | 0.0031 (14) | 0.0028 (15) |
| C12 | 0.0287 (16) | 0.0349 (17) | 0.048 (2) | 0.0004 (14) | −0.0018 (14) | −0.0023 (15) |
| C13 | 0.043 (2) | 0.047 (2) | 0.047 (2) | −0.0009 (17) | −0.0013 (16) | −0.0033 (17) |
| C14 | 0.050 (2) | 0.057 (2) | 0.051 (2) | −0.0101 (19) | 0.0047 (18) | 0.0104 (19) |
| C15 | 0.049 (2) | 0.0386 (19) | 0.065 (3) | −0.0122 (17) | −0.0025 (18) | 0.0105 (18) |
| C16 | 0.0316 (18) | 0.0357 (18) | 0.049 (2) | −0.0005 (14) | −0.0046 (15) | −0.0023 (16) |
| C17 | 0.062 (3) | 0.062 (3) | 0.061 (3) | 0.009 (2) | 0.009 (2) | 0.006 (2) |
| C18 | 0.281 (11) | 0.150 (7) | 0.117 (6) | 0.123 (7) | 0.099 (6) | 0.046 (5) |
| C19 | 0.105 (5) | 0.165 (6) | 0.128 (5) | 0.084 (5) | 0.029 (4) | 0.041 (5) |
| C20 | 0.051 (3) | 0.071 (3) | 0.073 (3) | −0.015 (2) | 0.001 (2) | −0.007 (2) |
| C21 | 0.084 (5) | 0.256 (10) | 0.159 (7) | −0.058 (6) | −0.004 (4) | −0.110 (7) |
| C22 | 0.049 (3) | 0.177 (7) | 0.146 (6) | −0.008 (4) | 0.026 (3) | −0.008 (5) |
| C23 | 0.054 (2) | 0.054 (2) | 0.043 (2) | 0.0032 (19) | 0.0003 (17) | 0.0010 (18) |
| C24 | 0.136 (5) | 0.072 (3) | 0.085 (4) | 0.001 (3) | −0.055 (3) | −0.002 (3) |
| C25 | 0.076 (3) | 0.059 (3) | 0.057 (3) | 0.015 (2) | −0.005 (2) | 0.009 (2) |
| C26 | 0.238 (9) | 0.122 (6) | 0.169 (7) | −0.015 (6) | 0.044 (7) | −0.062 (6) |
| C27 | 0.241 (10) | 0.278 (10) | 0.282 (10) | −0.034 (8) | 0.011 (8) | −0.061 (8) |
| C28 | 0.197 (8) | 0.158 (6) | 0.171 (7) | 0.023 (6) | −0.014 (6) | −0.016 (6) |
| Co1—O1 | 2.001 (2) | C2—C3 | 1.388 (4) |
| Co1—O3i | 2.247 (2) | C3—C4 | 1.387 (4) |
| Co1—O4i | 2.058 (2) | C3—H3 | 0.9300 |
| Co1—O7 | 2.383 (3) | C4—C5 | 1.369 (5) |
| Co1—C8i | 2.465 (3) | C4—C8 | 1.504 (4) |
| Co1—O8 | 2.082 (3) | C5—C6 | 1.383 (5) |
| Co1—O10ii | 2.008 (2) | C5—H5 | 0.9300 |
| Co2—O2 | 2.042 (2) | C6—C7 | 1.382 (4) |
| Co2—O7 | 2.091 (2) | C7—H7 | 0.9300 |
| Co2—O9ii | 2.082 (2) | C8—Co1iii | 2.465 (3) |
| Co2—O13 | 2.139 (3) | C9—C10 | 1.493 (5) |
| Co2—O14 | 2.100 (2) | C10—C15 | 1.371 (5) |
| Co2—O15 | 2.063 (2) | C10—C11 | 1.396 (4) |
| O1—C1 | 1.253 (4) | C11—C12 | 1.383 (5) |
| O2—C1 | 1.238 (4) | C11—H11 | 0.9300 |
| O3—C8 | 1.244 (4) | C12—C13 | 1.381 (5) |
| O3—Co1iii | 2.247 (2) | C12—C16 | 1.503 (4) |
| O4—C8 | 1.260 (4) | C13—C14 | 1.379 (5) |
| O4—Co1iii | 2.058 (2) | C13—H13 | 0.9300 |
| O5—N1 | 1.216 (4) | C14—C15 | 1.379 (5) |
| O6—N1 | 1.215 (4) | C15—H15 | 0.9300 |
| O7—C9 | 1.259 (4) | C17—H17 | 0.9300 |
| O8—C9 | 1.240 (4) | C18—H18A | 0.9600 |
| O9—C16 | 1.243 (4) | C18—H18B | 0.9600 |
| O9—Co2iv | 2.082 (2) | C18—H18C | 0.9600 |
| O10—C16 | 1.251 (4) | C19—H19A | 0.9600 |
| O10—Co1iv | 2.008 (2) | C19—H19B | 0.9600 |
| O11—N2 | 1.196 (5) | C19—H19C | 0.9600 |
| O12—N2 | 1.206 (5) | C20—H20 | 0.9300 |
| O13—C17 | 1.214 (4) | C21—H21A | 0.9600 |
| O14—C20 | 1.229 (4) | C21—H21B | 0.9600 |
| O15—C23 | 1.237 (4) | C21—H21C | 0.9600 |
| O16—C26 | 1.359 (8) | C22—H22A | 0.9600 |
| N1—C6 | 1.460 (5) | C22—H22B | 0.9600 |
| N2—C14 | 1.473 (5) | C22—H22C | 0.9600 |
| N3—C17 | 1.305 (5) | C23—H23 | 0.9300 |
| N3—C18 | 1.426 (6) | C24—H24A | 0.9600 |
| N3—C19 | 1.450 (5) | C24—H24B | 0.9600 |
| N4—C20 | 1.326 (5) | C24—H24C | 0.9600 |
| N4—C21 | 1.421 (6) | C25—H25A | 0.9600 |
| N4—C22 | 1.439 (5) | C25—H25B | 0.9600 |
| N5—C23 | 1.318 (4) | C25—H25C | 0.9600 |
| N5—C25 | 1.449 (4) | C26—H26 | 0.9300 |
| N5—C24 | 1.463 (5) | C27—H27A | 0.9600 |
| N6—C26 | 1.322 (8) | C27—H27B | 0.9600 |
| N6—C27 | 1.411 (8) | C27—H27C | 0.9600 |
| N6—C28 | 1.444 (7) | C28—H28A | 0.9600 |
| C1—C2 | 1.509 (4) | C28—H28B | 0.9600 |
| C2—C7 | 1.378 (5) | C28—H28C | 0.9600 |
| O1—Co1—O10ii | 96.82 (11) | O3—C8—C4 | 120.1 (3) |
| O1—Co1—O4i | 97.00 (10) | O4—C8—C4 | 118.2 (3) |
| O10ii—Co1—O4i | 100.24 (10) | O3—C8—Co1iii | 65.20 (18) |
| O1—Co1—O8 | 101.20 (11) | O4—C8—Co1iii | 56.52 (16) |
| O10ii—Co1—O8 | 148.98 (12) | C4—C8—Co1iii | 174.2 (3) |
| O4i—Co1—O8 | 102.36 (11) | O8—C9—O7 | 119.8 (4) |
| O1—Co1—O3i | 157.87 (10) | O8—C9—C10 | 119.8 (3) |
| O10ii—Co1—O3i | 87.29 (11) | O7—C9—C10 | 120.4 (4) |
| O4i—Co1—O3i | 60.88 (9) | C15—C10—C11 | 119.5 (3) |
| O8—Co1—O3i | 85.42 (12) | C15—C10—C9 | 122.2 (3) |
| O1—Co1—O7 | 104.29 (10) | C11—C10—C9 | 118.4 (3) |
| O10ii—Co1—O7 | 93.78 (9) | C12—C11—C10 | 121.5 (3) |
| O4i—Co1—O7 | 152.88 (9) | C12—C11—H11 | 119.3 |
| O8—Co1—O7 | 57.43 (10) | C10—C11—H11 | 119.3 |
| O3i—Co1—O7 | 97.09 (9) | C13—C12—C11 | 119.0 (3) |
| O1—Co1—C8i | 127.71 (11) | C13—C12—C16 | 120.9 (3) |
| O10ii—Co1—C8i | 94.08 (11) | C11—C12—C16 | 120.1 (3) |
| O4i—Co1—C8i | 30.72 (10) | C14—C13—C12 | 118.6 (3) |
| O8—Co1—C8i | 94.58 (11) | C14—C13—H13 | 120.7 |
| O3i—Co1—C8i | 30.16 (10) | C12—C13—H13 | 120.7 |
| O7—Co1—C8i | 125.81 (10) | C13—C14—C15 | 123.0 (3) |
| O2—Co2—O15 | 173.94 (11) | C13—C14—N2 | 118.3 (4) |
| O2—Co2—O9ii | 97.87 (10) | C15—C14—N2 | 118.7 (4) |
| O15—Co2—O9ii | 88.15 (10) | C10—C15—C14 | 118.3 (3) |
| O2—Co2—O7 | 91.26 (11) | C10—C15—H15 | 120.8 |
| O15—Co2—O7 | 89.54 (11) | C14—C15—H15 | 120.8 |
| O9ii—Co2—O7 | 89.27 (10) | O9—C16—O10 | 127.3 (3) |
| O2—Co2—O14 | 86.77 (11) | O9—C16—C12 | 117.3 (3) |
| O15—Co2—O14 | 92.79 (11) | O10—C16—C12 | 115.4 (3) |
| O9ii—Co2—O14 | 87.47 (10) | O13—C17—N3 | 126.3 (4) |
| O7—Co2—O14 | 175.92 (11) | O13—C17—H17 | 116.9 |
| O2—Co2—O13 | 87.22 (11) | N3—C17—H17 | 116.9 |
| O15—Co2—O13 | 86.74 (10) | N3—C18—H18A | 109.5 |
| O9ii—Co2—O13 | 174.03 (10) | N3—C18—H18B | 109.5 |
| O7—Co2—O13 | 93.76 (11) | H18A—C18—H18B | 109.5 |
| O14—Co2—O13 | 89.71 (11) | N3—C18—H18C | 109.5 |
| C1—O1—Co1 | 122.2 (2) | H18A—C18—H18C | 109.5 |
| C1—O2—Co2 | 149.4 (2) | H18B—C18—H18C | 109.5 |
| C8—O3—Co1iii | 84.64 (19) | N3—C19—H19A | 109.5 |
| C8—O4—Co1iii | 92.8 (2) | N3—C19—H19B | 109.5 |
| C9—O7—Co2 | 141.6 (2) | H19A—C19—H19B | 109.5 |
| C9—O7—Co1 | 84.1 (2) | N3—C19—H19C | 109.5 |
| Co2—O7—Co1 | 104.97 (11) | H19A—C19—H19C | 109.5 |
| C9—O8—Co1 | 98.6 (2) | H19B—C19—H19C | 109.5 |
| C16—O9—Co2iv | 136.0 (2) | O14—C20—N4 | 126.0 (4) |
| C16—O10—Co1iv | 132.0 (2) | O14—C20—H20 | 117.0 |
| C17—O13—Co2 | 128.5 (3) | N4—C20—H20 | 117.0 |
| C20—O14—Co2 | 126.0 (3) | N4—C21—H21A | 109.5 |
| C23—O15—Co2 | 123.1 (2) | N4—C21—H21B | 109.5 |
| O6—N1—O5 | 123.1 (4) | H21A—C21—H21B | 109.5 |
| O6—N1—C6 | 118.2 (3) | N4—C21—H21C | 109.5 |
| O5—N1—C6 | 118.7 (3) | H21A—C21—H21C | 109.5 |
| O11—N2—O12 | 122.3 (4) | H21B—C21—H21C | 109.5 |
| O11—N2—C14 | 119.6 (4) | N4—C22—H22A | 109.5 |
| O12—N2—C14 | 118.1 (4) | N4—C22—H22B | 109.5 |
| C17—N3—C18 | 119.7 (4) | H22A—C22—H22B | 109.5 |
| C17—N3—C19 | 123.1 (4) | N4—C22—H22C | 109.5 |
| C18—N3—C19 | 117.2 (4) | H22A—C22—H22C | 109.5 |
| C20—N4—C21 | 119.5 (4) | H22B—C22—H22C | 109.5 |
| C20—N4—C22 | 123.7 (4) | O15—C23—N5 | 124.7 (4) |
| C21—N4—C22 | 116.8 (5) | O15—C23—H23 | 117.6 |
| C23—N5—C25 | 121.9 (3) | N5—C23—H23 | 117.6 |
| C23—N5—C24 | 120.6 (3) | N5—C24—H24A | 109.5 |
| C25—N5—C24 | 117.5 (3) | N5—C24—H24B | 109.5 |
| C26—N6—C27 | 120.0 (9) | H24A—C24—H24B | 109.5 |
| C26—N6—C28 | 128.5 (9) | N5—C24—H24C | 109.5 |
| C27—N6—C28 | 111.6 (9) | H24A—C24—H24C | 109.5 |
| O2—C1—O1 | 126.9 (3) | H24B—C24—H24C | 109.5 |
| O2—C1—C2 | 116.1 (3) | N5—C25—H25A | 109.5 |
| O1—C1—C2 | 116.9 (3) | N5—C25—H25B | 109.5 |
| C7—C2—C3 | 119.8 (3) | H25A—C25—H25B | 109.5 |
| C7—C2—C1 | 121.0 (3) | N5—C25—H25C | 109.5 |
| C3—C2—C1 | 119.2 (3) | H25A—C25—H25C | 109.5 |
| C4—C3—C2 | 120.5 (3) | H25B—C25—H25C | 109.5 |
| C4—C3—H3 | 119.7 | N6—C26—O16 | 105.3 (9) |
| C2—C3—H3 | 119.7 | N6—C26—H26 | 127.4 |
| C5—C4—C3 | 120.2 (3) | O16—C26—H26 | 127.4 |
| C5—C4—C8 | 121.5 (3) | N6—C27—H27A | 109.5 |
| C3—C4—C8 | 118.3 (3) | N6—C27—H27B | 109.5 |
| C4—C5—C6 | 118.5 (3) | H27A—C27—H27B | 109.5 |
| C4—C5—H5 | 120.7 | N6—C27—H27C | 109.5 |
| C6—C5—H5 | 120.7 | H27A—C27—H27C | 109.5 |
| C7—C6—C5 | 122.4 (3) | H27B—C27—H27C | 109.5 |
| C7—C6—N1 | 118.3 (3) | N6—C28—H28A | 109.5 |
| C5—C6—N1 | 119.3 (3) | N6—C28—H28B | 109.5 |
| C2—C7—C6 | 118.5 (3) | H28A—C28—H28B | 109.5 |
| C2—C7—H7 | 120.7 | N6—C28—H28C | 109.5 |
| C6—C7—H7 | 120.7 | H28A—C28—H28C | 109.5 |
| O3—C8—O4 | 121.7 (3) | H28B—C28—H28C | 109.5 |
| O10ii—Co1—O1—C1 | −72.3 (3) | C4—C5—C6—C7 | 2.9 (5) |
| O4i—Co1—O1—C1 | −173.5 (3) | C4—C5—C6—N1 | −177.5 (3) |
| O8—Co1—O1—C1 | 82.4 (3) | O6—N1—C6—C7 | −4.0 (5) |
| O3i—Co1—O1—C1 | −171.9 (3) | O5—N1—C6—C7 | 175.0 (4) |
| O7—Co1—O1—C1 | 23.4 (3) | O6—N1—C6—C5 | 176.3 (4) |
| C8i—Co1—O1—C1 | −172.8 (2) | O5—N1—C6—C5 | −4.7 (5) |
| O9ii—Co2—O2—C1 | 53.7 (5) | C3—C2—C7—C6 | 0.7 (5) |
| O7—Co2—O2—C1 | −35.7 (5) | C1—C2—C7—C6 | −179.5 (3) |
| O14—Co2—O2—C1 | 140.7 (5) | C5—C6—C7—C2 | −2.8 (5) |
| O13—Co2—O2—C1 | −129.4 (5) | N1—C6—C7—C2 | 177.5 (3) |
| O2—Co2—O7—C9 | −59.1 (5) | Co1iii—O3—C8—O4 | −0.7 (3) |
| O15—Co2—O7—C9 | 114.8 (5) | Co1iii—O3—C8—C4 | 177.4 (3) |
| O9ii—Co2—O7—C9 | −157.0 (5) | Co1iii—O4—C8—O3 | 0.7 (4) |
| O13—Co2—O7—C9 | 28.1 (5) | Co1iii—O4—C8—C4 | −177.4 (3) |
| O2—Co2—O7—Co1 | 40.41 (11) | C5—C4—C8—O3 | −176.8 (3) |
| O15—Co2—O7—Co1 | −145.60 (11) | C3—C4—C8—O3 | 2.4 (5) |
| O9ii—Co2—O7—Co1 | −57.44 (10) | C5—C4—C8—O4 | 1.4 (5) |
| O13—Co2—O7—Co1 | 127.70 (10) | C3—C4—C8—O4 | −179.5 (3) |
| O1—Co1—O7—C9 | 96.0 (2) | Co1—O8—C9—O7 | 3.2 (4) |
| O10ii—Co1—O7—C9 | −166.0 (2) | Co1—O8—C9—C10 | −174.3 (3) |
| O4i—Co1—O7—C9 | −44.6 (3) | Co2—O7—C9—O8 | 103.9 (5) |
| O8—Co1—O7—C9 | 1.7 (2) | Co1—O7—C9—O8 | −2.8 (3) |
| O3i—Co1—O7—C9 | −78.2 (2) | Co2—O7—C9—C10 | −78.5 (5) |
| C8i—Co1—O7—C9 | −68.2 (2) | Co1—O7—C9—C10 | 174.8 (3) |
| O1—Co1—O7—Co2 | −46.01 (12) | O8—C9—C10—C15 | −171.4 (3) |
| O10ii—Co1—O7—Co2 | 52.01 (12) | O7—C9—C10—C15 | 11.1 (5) |
| O4i—Co1—O7—Co2 | 173.32 (15) | O8—C9—C10—C11 | 8.6 (5) |
| O8—Co1—O7—Co2 | −140.32 (15) | O7—C9—C10—C11 | −168.9 (3) |
| O3i—Co1—O7—Co2 | 139.75 (11) | C15—C10—C11—C12 | 1.5 (5) |
| C8i—Co1—O7—Co2 | 149.80 (11) | C9—C10—C11—C12 | −178.5 (3) |
| O1—Co1—O8—C9 | −101.7 (2) | C10—C11—C12—C13 | 0.3 (5) |
| O10ii—Co1—O8—C9 | 22.7 (4) | C10—C11—C12—C16 | 177.3 (3) |
| O4i—Co1—O8—C9 | 158.5 (2) | C11—C12—C13—C14 | −1.5 (5) |
| O3i—Co1—O8—C9 | 99.7 (2) | C16—C12—C13—C14 | −178.5 (3) |
| O7—Co1—O8—C9 | −1.7 (2) | C12—C13—C14—C15 | 0.9 (6) |
| C8i—Co1—O8—C9 | 128.4 (2) | C12—C13—C14—N2 | 179.7 (3) |
| O2—Co2—O13—C17 | −7.4 (3) | O11—N2—C14—C13 | 3.7 (7) |
| O15—Co2—O13—C17 | 172.2 (3) | O12—N2—C14—C13 | −179.4 (5) |
| O7—Co2—O13—C17 | −98.5 (3) | O11—N2—C14—C15 | −177.5 (4) |
| O14—Co2—O13—C17 | 79.4 (3) | O12—N2—C14—C15 | −0.6 (7) |
| O2—Co2—O14—C20 | 95.1 (3) | C11—C10—C15—C14 | −2.0 (5) |
| O15—Co2—O14—C20 | −78.8 (3) | C9—C10—C15—C14 | 178.0 (3) |
| O9ii—Co2—O14—C20 | −166.9 (3) | C13—C14—C15—C10 | 0.8 (6) |
| O13—Co2—O14—C20 | 7.9 (3) | N2—C14—C15—C10 | −177.9 (4) |
| O9ii—Co2—O15—C23 | 38.7 (2) | Co2iv—O9—C16—O10 | 2.3 (6) |
| O7—Co2—O15—C23 | 128.0 (2) | Co2iv—O9—C16—C12 | −177.6 (2) |
| O14—Co2—O15—C23 | −48.7 (2) | C13—C12—C16—O9 | −160.5 (3) |
| O13—Co2—O15—C23 | −138.2 (2) | C11—C12—C16—O9 | 22.5 (5) |
| Co2—O2—C1—O1 | 8.8 (8) | C13—C12—C16—O10 | 19.6 (5) |
| Co2—O2—C1—C2 | −171.4 (4) | C11—C12—C16—O10 | −157.4 (3) |
| Co1—O1—C1—O2 | −1.7 (5) | Co2—O13—C17—N3 | −153.3 (3) |
| Co1—O1—C1—C2 | 178.5 (2) | C18—N3—C17—O13 | 0.2 (4) |
| O2—C1—C2—C7 | 171.4 (3) | C19—N3—C17—O13 | 178.7 (3) |
| O1—C1—C2—C7 | −8.7 (5) | Co2—O14—C20—N4 | −149.3 (3) |
| O2—C1—C2—C3 | −8.8 (5) | C21—N4—C20—O14 | 0.2 (3) |
| O1—C1—C2—C3 | 171.1 (3) | C22—N4—C20—O14 | 179.4 (3) |
| C7—C2—C3—C4 | 1.3 (5) | Co2—O15—C23—N5 | −161.2 (2) |
| C1—C2—C3—C4 | −178.5 (3) | C25—N5—C23—O15 | 179.4 (3) |
| C2—C3—C4—C5 | −1.3 (5) | C24—N5—C23—O15 | 0.2 (3) |
| C2—C3—C4—C8 | 179.6 (3) | C27—N6—C26—O16 | −0.3 (3) |
| C3—C4—C5—C6 | −0.7 (5) | C28—N6—C26—O16 | 179.0 (3) |
| C8—C4—C5—C6 | 178.4 (3) |
Selected bond lengths (Å)
| Co1—O1 | 2.001 (2) |
| Co1—O3i | 2.247 (2) |
| Co1—O4i | 2.058 (2) |
| Co1—O7 | 2.383 (3) |
| Co1—O8 | 2.082 (3) |
| Co1—O10ii | 2.008 (2) |
| Co2—O2 | 2.042 (2) |
| Co2—O7 | 2.091 (2) |
| Co2—O9ii | 2.082 (2) |
| Co2—O13 | 2.139 (3) |
| Co2—O14 | 2.100 (2) |
| Co2—O15 | 2.063 (2) |
Symmetry codes: (i) ; (ii) .