| Literature DB >> 21589319 |
Weiqin Dong1, Yaling Cai, Bo Hong, Hongxiao Jin.
Abstract
In the mononuclear title complex, [Dy(C(7)H(5)O(4))(2)(NO(3))(C(12)H(8)N(2))(2)], the Dy(III) atom is in a distorted bicapped square-anti-prismatic geometry formed by four N atoms from two chelating 1,10-phenanthroline (phen) ligands, four O atoms from two 2,6-dihy-droxy-benzoate (DHB) ligands and two O atoms from a nitrate anion. Inter-molecular π-π stacking inter-actions between the phen and DHB ligands [centroid-centroid distances = 3.542 (4) and 3.879 (4) Å] and between the pyridine and benzene rings of adjacent phen ligands [centroid-centroid distance = 3.751 (4) Å] stabilize the crystal structure. Intra-molecular O-H⋯O hydrogen bonds are observed in the DHB ligands.Entities:
Year: 2010 PMID: 21589319 PMCID: PMC3011458 DOI: 10.1107/S1600536810048348
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Dy(C7H5O4)2(NO3)(C12H8N2)2] | |
| Monoclinic, | Cu |
| Hall symbol: -P 2ybc | Cell parameters from 5391 reflections |
| θ = 3.3–67.5° | |
| µ = 12.46 mm−1 | |
| β = 127.280 (2)° | Prism, yellow |
| 0.35 × 0.32 × 0.30 mm | |
| Oxford Diffraction Gemini S Ultra CCD diffractometer | 5923 independent reflections |
| Radiation source: Enhance (Cu) X-ray Source | 4674 reflections with |
| graphite | |
| Detector resolution: 15.9149 pixels mm-1 | θmax = 67.1°, θmin = 3.3° |
| ω scans | |
| Absorption correction: multi-scan ( | |
| 11595 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 | |
| 5923 reflections | (Δ/σ)max < 0.001 |
| 496 parameters | Δρmax = 1.68 e Å−3 |
| 0 restraints | Δρmin = −1.16 e Å−3 |
| Dy1 | 0.92866 (4) | 0.862990 (11) | 0.22227 (3) | 0.03846 (13) | |
| O1 | 0.8450 (5) | 0.83886 (15) | 0.0261 (4) | 0.0522 (11) | |
| O2 | 0.8884 (5) | 0.91905 (15) | 0.0604 (4) | 0.0499 (10) | |
| O3 | 0.7499 (6) | 0.80195 (16) | −0.1748 (4) | 0.0702 (15) | |
| H27 | 0.7912 | 0.8015 | −0.1039 | 0.105* | |
| O4 | 0.8352 (8) | 0.97830 (17) | −0.1043 (5) | 0.087 (2) | |
| H31 | 0.8578 | 0.9702 | −0.0400 | 0.131* | |
| O5 | 0.6975 (5) | 0.81369 (15) | 0.1368 (4) | 0.0505 (10) | |
| O6 | 0.6691 (5) | 0.89410 (16) | 0.1017 (4) | 0.0584 (12) | |
| O7 | 0.4806 (6) | 0.76073 (17) | 0.1052 (4) | 0.0624 (12) | |
| H34 | 0.5706 | 0.7671 | 0.1414 | 0.094* | |
| O8 | 0.4205 (7) | 0.93749 (19) | 0.0292 (6) | 0.0822 (17) | |
| H38 | 0.5048 | 0.9344 | 0.0461 | 0.123* | |
| O9 | 0.9472 (5) | 0.80198 (15) | 0.3727 (4) | 0.0583 (12) | |
| O10 | 0.8436 (6) | 0.87351 (16) | 0.3467 (4) | 0.0556 (11) | |
| O11 | 0.8566 (7) | 0.8210 (3) | 0.4675 (5) | 0.0883 (19) | |
| N1 | 1.1603 (6) | 0.87915 (17) | 0.4391 (4) | 0.0408 (11) | |
| N2 | 0.9734 (6) | 0.95380 (16) | 0.2914 (4) | 0.0442 (12) | |
| N3 | 1.1761 (6) | 0.86887 (16) | 0.2491 (4) | 0.0406 (11) | |
| N4 | 1.0506 (6) | 0.78088 (18) | 0.2394 (4) | 0.0435 (11) | |
| N5 | 0.8816 (6) | 0.8312 (2) | 0.3985 (5) | 0.0527 (13) | |
| C1 | 1.2533 (8) | 0.8434 (2) | 0.5122 (6) | 0.0483 (14) | |
| H1 | 1.2385 | 0.8112 | 0.4820 | 0.058* | |
| C2 | 1.3706 (8) | 0.8506 (3) | 0.6301 (6) | 0.0560 (16) | |
| H2 | 1.4331 | 0.8242 | 0.6768 | 0.067* | |
| C3 | 1.3928 (8) | 0.8974 (3) | 0.6766 (6) | 0.0569 (17) | |
| H3 | 1.4692 | 0.9030 | 0.7561 | 0.068* | |
| C4 | 1.2998 (7) | 0.9369 (2) | 0.6037 (5) | 0.0463 (14) | |
| C5 | 1.1836 (7) | 0.9259 (2) | 0.4851 (5) | 0.0400 (12) | |
| C6 | 1.0847 (7) | 0.9650 (2) | 0.4065 (5) | 0.0416 (13) | |
| C7 | 1.1054 (8) | 1.0142 (2) | 0.4516 (6) | 0.0478 (15) | |
| C8 | 1.2255 (8) | 1.0234 (2) | 0.5743 (7) | 0.0583 (18) | |
| H8 | 1.2388 | 1.0555 | 0.6044 | 0.070* | |
| C9 | 1.3175 (9) | 0.9870 (3) | 0.6454 (7) | 0.0618 (19) | |
| H9 | 1.3950 | 0.9943 | 0.7238 | 0.074* | |
| C10 | 1.0063 (9) | 1.0512 (2) | 0.3732 (6) | 0.0554 (17) | |
| H10 | 1.0169 | 1.0839 | 0.3991 | 0.066* | |
| C11 | 0.8959 (9) | 1.0395 (2) | 0.2603 (7) | 0.0590 (18) | |
| H11 | 0.8283 | 1.0638 | 0.2082 | 0.071* | |
| C12 | 0.8835 (8) | 0.9907 (2) | 0.2220 (6) | 0.0521 (15) | |
| H12 | 0.8078 | 0.9836 | 0.1432 | 0.063* | |
| C13 | 1.2359 (8) | 0.9120 (2) | 0.2500 (6) | 0.0528 (15) | |
| H13 | 1.1765 | 0.9406 | 0.2248 | 0.063* | |
| C14 | 1.3846 (8) | 0.9163 (3) | 0.2873 (6) | 0.0563 (17) | |
| H14 | 1.4228 | 0.9473 | 0.2875 | 0.068* | |
| C15 | 1.4723 (8) | 0.8747 (3) | 0.3231 (6) | 0.0594 (18) | |
| H15 | 1.5715 | 0.8772 | 0.3488 | 0.071* | |
| C16 | 1.4132 (7) | 0.8282 (3) | 0.3211 (5) | 0.0489 (15) | |
| C17 | 1.2625 (7) | 0.8270 (2) | 0.2827 (5) | 0.0429 (13) | |
| C18 | 1.1934 (7) | 0.7804 (2) | 0.2724 (5) | 0.0413 (13) | |
| C19 | 1.2765 (7) | 0.7358 (2) | 0.2975 (5) | 0.0475 (14) | |
| C20 | 1.4291 (8) | 0.7381 (3) | 0.3411 (6) | 0.0588 (18) | |
| H20 | 1.4846 | 0.7087 | 0.3620 | 0.071* | |
| C21 | 1.4956 (8) | 0.7820 (3) | 0.3529 (6) | 0.0595 (18) | |
| H21 | 1.5963 | 0.7826 | 0.3820 | 0.071* | |
| C22 | 1.1985 (8) | 0.6906 (2) | 0.2765 (6) | 0.0545 (17) | |
| H22 | 1.2462 | 0.6603 | 0.2879 | 0.065* | |
| C23 | 1.0545 (8) | 0.6914 (2) | 0.2399 (6) | 0.0535 (17) | |
| H23 | 1.0027 | 0.6617 | 0.2261 | 0.064* | |
| C24 | 0.9842 (8) | 0.7374 (2) | 0.2232 (5) | 0.0491 (15) | |
| H24 | 0.8857 | 0.7373 | 0.1994 | 0.059* | |
| C25 | 0.8441 (7) | 0.8824 (2) | −0.0106 (5) | 0.0425 (13) | |
| C26 | 0.7959 (7) | 0.8895 (2) | −0.1304 (5) | 0.0416 (13) | |
| C27 | 0.7498 (7) | 0.8487 (2) | −0.2084 (5) | 0.0482 (15) | |
| C28 | 0.7019 (8) | 0.8562 (3) | −0.3224 (6) | 0.0608 (19) | |
| H28 | 0.6718 | 0.8292 | −0.3732 | 0.073* | |
| C29 | 0.6992 (9) | 0.9035 (3) | −0.3599 (6) | 0.069 (2) | |
| H29 | 0.6661 | 0.9082 | −0.4367 | 0.083* | |
| C30 | 0.7440 (10) | 0.9440 (3) | −0.2870 (6) | 0.068 (2) | |
| H30 | 0.7418 | 0.9758 | −0.3144 | 0.082* | |
| C31 | 0.7926 (9) | 0.9375 (2) | −0.1728 (6) | 0.0582 (18) | |
| C32 | 0.6131 (7) | 0.8522 (2) | 0.1013 (5) | 0.0474 (15) | |
| C33 | 0.4611 (7) | 0.8492 (2) | 0.0671 (5) | 0.0460 (14) | |
| C34 | 0.4014 (7) | 0.8037 (3) | 0.0719 (5) | 0.0504 (15) | |
| C35 | 0.2580 (7) | 0.8010 (3) | 0.0423 (5) | 0.0555 (17) | |
| H35 | 0.2199 | 0.7707 | 0.0459 | 0.067* | |
| C36 | 0.1724 (8) | 0.8441 (3) | 0.0071 (6) | 0.067 (2) | |
| H36 | 0.0754 | 0.8422 | −0.0139 | 0.080* | |
| C37 | 0.2255 (9) | 0.8898 (3) | 0.0021 (6) | 0.067 (2) | |
| H37 | 0.1658 | 0.9183 | −0.0214 | 0.081* | |
| C38 | 0.3692 (8) | 0.8923 (3) | 0.0329 (6) | 0.0594 (18) |
| Dy1 | 0.0455 (2) | 0.02877 (18) | 0.0461 (2) | −0.00037 (13) | 0.03041 (17) | −0.00158 (13) |
| O1 | 0.065 (3) | 0.039 (2) | 0.050 (2) | −0.0029 (19) | 0.033 (2) | 0.0047 (18) |
| O2 | 0.066 (3) | 0.040 (2) | 0.050 (2) | −0.0004 (19) | 0.038 (2) | −0.0041 (18) |
| O3 | 0.083 (4) | 0.044 (2) | 0.057 (3) | −0.004 (2) | 0.028 (3) | −0.008 (2) |
| O4 | 0.154 (6) | 0.043 (2) | 0.066 (3) | −0.019 (3) | 0.067 (4) | −0.005 (2) |
| O5 | 0.046 (2) | 0.041 (2) | 0.064 (3) | 0.0088 (18) | 0.033 (2) | 0.0041 (19) |
| O6 | 0.060 (3) | 0.044 (2) | 0.075 (3) | 0.002 (2) | 0.043 (3) | 0.009 (2) |
| O7 | 0.059 (3) | 0.052 (2) | 0.075 (3) | 0.002 (2) | 0.041 (3) | 0.010 (2) |
| O8 | 0.076 (4) | 0.053 (3) | 0.110 (4) | 0.019 (3) | 0.053 (3) | 0.017 (3) |
| O9 | 0.066 (3) | 0.040 (2) | 0.069 (3) | 0.000 (2) | 0.040 (3) | 0.000 (2) |
| O10 | 0.067 (3) | 0.049 (2) | 0.070 (3) | 0.004 (2) | 0.052 (3) | −0.002 (2) |
| O11 | 0.097 (4) | 0.129 (5) | 0.066 (3) | −0.013 (4) | 0.063 (3) | 0.010 (3) |
| N1 | 0.053 (3) | 0.033 (2) | 0.046 (3) | 0.002 (2) | 0.035 (2) | 0.0000 (19) |
| N2 | 0.063 (3) | 0.029 (2) | 0.046 (3) | 0.003 (2) | 0.035 (3) | 0.0012 (19) |
| N3 | 0.043 (3) | 0.037 (2) | 0.050 (3) | −0.006 (2) | 0.033 (2) | −0.004 (2) |
| N4 | 0.051 (3) | 0.038 (2) | 0.043 (2) | −0.005 (2) | 0.029 (2) | −0.001 (2) |
| N5 | 0.050 (3) | 0.060 (3) | 0.052 (3) | −0.006 (3) | 0.033 (3) | −0.005 (3) |
| C1 | 0.061 (4) | 0.041 (3) | 0.055 (4) | 0.006 (3) | 0.042 (3) | 0.004 (3) |
| C2 | 0.053 (4) | 0.063 (4) | 0.051 (4) | 0.009 (3) | 0.031 (3) | 0.007 (3) |
| C3 | 0.047 (3) | 0.072 (4) | 0.051 (3) | −0.006 (3) | 0.029 (3) | −0.006 (3) |
| C4 | 0.043 (3) | 0.049 (3) | 0.053 (3) | −0.007 (3) | 0.032 (3) | −0.008 (3) |
| C5 | 0.045 (3) | 0.039 (3) | 0.049 (3) | −0.005 (2) | 0.035 (3) | −0.005 (2) |
| C6 | 0.052 (3) | 0.033 (3) | 0.053 (3) | −0.006 (2) | 0.039 (3) | −0.003 (2) |
| C7 | 0.064 (4) | 0.036 (3) | 0.072 (4) | −0.015 (3) | 0.056 (4) | −0.013 (3) |
| C8 | 0.074 (5) | 0.044 (3) | 0.083 (5) | −0.021 (3) | 0.061 (4) | −0.022 (3) |
| C9 | 0.063 (4) | 0.062 (4) | 0.068 (4) | −0.023 (4) | 0.043 (4) | −0.026 (4) |
| C10 | 0.086 (5) | 0.029 (3) | 0.081 (5) | −0.004 (3) | 0.067 (4) | −0.003 (3) |
| C11 | 0.084 (5) | 0.034 (3) | 0.079 (5) | 0.012 (3) | 0.060 (4) | 0.014 (3) |
| C12 | 0.068 (4) | 0.037 (3) | 0.059 (4) | 0.004 (3) | 0.042 (3) | 0.002 (3) |
| C13 | 0.061 (4) | 0.045 (3) | 0.060 (4) | −0.005 (3) | 0.041 (3) | −0.005 (3) |
| C14 | 0.059 (4) | 0.060 (4) | 0.064 (4) | −0.023 (3) | 0.044 (4) | −0.012 (3) |
| C15 | 0.053 (4) | 0.077 (5) | 0.055 (4) | −0.019 (4) | 0.036 (3) | −0.010 (3) |
| C16 | 0.041 (3) | 0.067 (4) | 0.040 (3) | −0.006 (3) | 0.026 (3) | −0.006 (3) |
| C17 | 0.045 (3) | 0.046 (3) | 0.038 (3) | −0.003 (3) | 0.026 (3) | −0.007 (2) |
| C18 | 0.048 (3) | 0.045 (3) | 0.034 (3) | 0.000 (3) | 0.027 (3) | −0.002 (2) |
| C19 | 0.056 (4) | 0.051 (3) | 0.040 (3) | 0.012 (3) | 0.032 (3) | 0.004 (3) |
| C20 | 0.059 (4) | 0.064 (4) | 0.049 (4) | 0.016 (3) | 0.030 (3) | 0.005 (3) |
| C21 | 0.047 (4) | 0.084 (5) | 0.050 (4) | 0.007 (4) | 0.031 (3) | 0.000 (3) |
| C22 | 0.073 (5) | 0.039 (3) | 0.052 (4) | 0.012 (3) | 0.039 (3) | 0.002 (3) |
| C23 | 0.073 (5) | 0.032 (3) | 0.055 (4) | 0.000 (3) | 0.039 (3) | −0.003 (3) |
| C24 | 0.051 (3) | 0.038 (3) | 0.056 (4) | −0.009 (3) | 0.031 (3) | −0.006 (3) |
| C25 | 0.045 (3) | 0.041 (3) | 0.046 (3) | −0.001 (2) | 0.030 (3) | −0.001 (2) |
| C26 | 0.044 (3) | 0.040 (3) | 0.041 (3) | −0.002 (2) | 0.026 (3) | −0.001 (2) |
| C27 | 0.040 (3) | 0.048 (3) | 0.047 (3) | 0.005 (3) | 0.021 (3) | −0.005 (3) |
| C28 | 0.055 (4) | 0.072 (5) | 0.049 (4) | 0.000 (3) | 0.028 (3) | −0.017 (3) |
| C29 | 0.078 (5) | 0.084 (5) | 0.048 (4) | −0.010 (4) | 0.039 (4) | −0.005 (4) |
| C30 | 0.094 (6) | 0.063 (4) | 0.059 (4) | −0.010 (4) | 0.052 (4) | 0.007 (3) |
| C31 | 0.078 (5) | 0.047 (3) | 0.052 (4) | −0.010 (3) | 0.040 (4) | 0.000 (3) |
| C32 | 0.050 (4) | 0.049 (3) | 0.040 (3) | 0.003 (3) | 0.026 (3) | 0.002 (3) |
| C33 | 0.041 (3) | 0.058 (3) | 0.040 (3) | 0.004 (3) | 0.025 (3) | −0.002 (3) |
| C34 | 0.045 (3) | 0.067 (4) | 0.042 (3) | 0.001 (3) | 0.028 (3) | 0.000 (3) |
| C35 | 0.047 (4) | 0.079 (5) | 0.044 (3) | −0.002 (3) | 0.029 (3) | 0.000 (3) |
| C36 | 0.048 (4) | 0.105 (6) | 0.049 (4) | 0.007 (4) | 0.031 (3) | −0.001 (4) |
| C37 | 0.057 (4) | 0.085 (5) | 0.060 (4) | 0.029 (4) | 0.035 (4) | 0.008 (4) |
| C38 | 0.058 (4) | 0.066 (4) | 0.053 (4) | 0.015 (3) | 0.033 (3) | 0.006 (3) |
| Dy1—N1 | 2.597 (5) | C9—H9 | 0.9300 |
| Dy1—N2 | 2.556 (4) | C10—C11 | 1.344 (10) |
| Dy1—N3 | 2.545 (5) | C10—H10 | 0.9300 |
| Dy1—N4 | 2.515 (5) | C11—C12 | 1.389 (9) |
| Dy1—O1 | 2.442 (4) | C11—H11 | 0.9300 |
| Dy1—O2 | 2.557 (4) | C12—H12 | 0.9300 |
| Dy1—O5 | 2.458 (4) | C13—C14 | 1.403 (9) |
| Dy1—O6 | 2.444 (5) | C13—H13 | 0.9300 |
| Dy1—O9 | 2.604 (5) | C14—C15 | 1.360 (11) |
| Dy1—O10 | 2.482 (5) | C14—H14 | 0.9300 |
| O1—C25 | 1.274 (7) | C15—C16 | 1.401 (10) |
| O2—C25 | 1.275 (7) | C15—H15 | 0.9300 |
| O3—C27 | 1.340 (8) | C16—C17 | 1.414 (8) |
| O3—H27 | 0.8196 | C16—C21 | 1.439 (10) |
| O4—C31 | 1.345 (8) | C17—C18 | 1.425 (8) |
| O4—H31 | 0.8201 | C18—C19 | 1.417 (8) |
| O5—C32 | 1.275 (7) | C19—C22 | 1.410 (10) |
| O6—C32 | 1.281 (8) | C19—C20 | 1.413 (10) |
| O7—C34 | 1.348 (8) | C20—C21 | 1.344 (11) |
| O7—H34 | 0.8198 | C20—H20 | 0.9300 |
| O8—C38 | 1.352 (9) | C21—H21 | 0.9300 |
| O8—H38 | 0.8190 | C22—C23 | 1.352 (10) |
| O9—N5 | 1.267 (7) | C22—H22 | 0.9300 |
| O10—N5 | 1.277 (7) | C23—C24 | 1.398 (9) |
| O11—N5 | 1.205 (7) | C23—H23 | 0.9300 |
| N1—C1 | 1.330 (8) | C24—H24 | 0.9300 |
| N1—C5 | 1.363 (7) | C25—C26 | 1.462 (8) |
| N2—C12 | 1.326 (8) | C26—C31 | 1.411 (9) |
| N2—C6 | 1.363 (8) | C26—C27 | 1.415 (8) |
| N3—C13 | 1.328 (8) | C27—C28 | 1.386 (10) |
| N3—C17 | 1.360 (8) | C28—C29 | 1.365 (11) |
| N4—C24 | 1.322 (8) | C28—H28 | 0.9300 |
| N4—C18 | 1.356 (8) | C29—C30 | 1.371 (11) |
| C1—C2 | 1.382 (9) | C29—H29 | 0.9300 |
| C1—H1 | 0.9300 | C30—C31 | 1.383 (10) |
| C2—C3 | 1.367 (10) | C30—H30 | 0.9300 |
| C2—H2 | 0.9300 | C32—C33 | 1.452 (9) |
| C3—C4 | 1.402 (10) | C33—C34 | 1.407 (9) |
| C3—H3 | 0.9300 | C33—C38 | 1.418 (9) |
| C4—C5 | 1.404 (8) | C34—C35 | 1.383 (9) |
| C4—C9 | 1.433 (9) | C35—C36 | 1.384 (11) |
| C5—C6 | 1.439 (8) | C35—H35 | 0.9300 |
| C6—C7 | 1.420 (8) | C36—C37 | 1.379 (12) |
| C7—C10 | 1.398 (9) | C36—H36 | 0.9300 |
| C7—C8 | 1.442 (10) | C37—C38 | 1.380 (10) |
| C8—C9 | 1.329 (11) | C37—H37 | 0.9300 |
| C8—H8 | 0.9300 | ||
| O1—Dy1—O6 | 79.39 (17) | C9—C8—H8 | 119.4 |
| O1—Dy1—O5 | 74.42 (15) | C7—C8—H8 | 119.4 |
| O6—Dy1—O5 | 53.02 (13) | C8—C9—C4 | 121.4 (6) |
| O1—Dy1—O10 | 143.53 (17) | C8—C9—H9 | 119.3 |
| O6—Dy1—O10 | 70.42 (17) | C4—C9—H9 | 119.3 |
| O5—Dy1—O10 | 71.23 (16) | C11—C10—C7 | 120.0 (6) |
| O1—Dy1—N4 | 71.90 (15) | C11—C10—H10 | 120.0 |
| O6—Dy1—N4 | 134.73 (16) | C7—C10—H10 | 120.0 |
| O5—Dy1—N4 | 85.41 (15) | C10—C11—C12 | 119.4 (6) |
| O10—Dy1—N4 | 116.50 (15) | C10—C11—H11 | 120.3 |
| O1—Dy1—N3 | 79.34 (16) | C12—C11—H11 | 120.3 |
| O6—Dy1—N3 | 142.59 (16) | N2—C12—C11 | 123.8 (6) |
| O5—Dy1—N3 | 145.01 (14) | N2—C12—H12 | 118.1 |
| O10—Dy1—N3 | 137.05 (16) | C11—C12—H12 | 118.1 |
| N4—Dy1—N3 | 64.45 (15) | N3—C13—C14 | 122.9 (6) |
| O1—Dy1—N2 | 122.95 (14) | N3—C13—H13 | 118.5 |
| O6—Dy1—N2 | 79.54 (16) | C14—C13—H13 | 118.5 |
| O5—Dy1—N2 | 127.03 (16) | C15—C14—C13 | 119.2 (6) |
| O10—Dy1—N2 | 71.66 (16) | C15—C14—H14 | 120.4 |
| N4—Dy1—N2 | 145.66 (16) | C13—C14—H14 | 120.4 |
| N3—Dy1—N2 | 86.76 (16) | C14—C15—C16 | 119.9 (7) |
| O1—Dy1—O2 | 51.87 (12) | C14—C15—H15 | 120.0 |
| O6—Dy1—O2 | 71.26 (16) | C16—C15—H15 | 120.0 |
| O5—Dy1—O2 | 107.97 (14) | C15—C16—C17 | 117.4 (6) |
| O10—Dy1—O2 | 130.24 (14) | C15—C16—C21 | 123.7 (7) |
| N4—Dy1—O2 | 112.92 (15) | C17—C16—C21 | 118.9 (6) |
| N3—Dy1—O2 | 71.39 (15) | N3—C17—C16 | 122.5 (6) |
| N2—Dy1—O2 | 71.20 (14) | N3—C17—C18 | 117.6 (5) |
| O1—Dy1—N1 | 145.48 (16) | C16—C17—C18 | 119.9 (6) |
| O6—Dy1—N1 | 132.75 (16) | N4—C18—C19 | 122.9 (6) |
| O5—Dy1—N1 | 131.74 (15) | N4—C18—C17 | 118.2 (5) |
| O10—Dy1—N1 | 70.26 (16) | C19—C18—C17 | 118.8 (6) |
| N4—Dy1—N1 | 86.66 (15) | C22—C19—C20 | 123.5 (6) |
| N3—Dy1—N1 | 66.91 (16) | C22—C19—C18 | 116.4 (6) |
| N2—Dy1—N1 | 63.96 (15) | C20—C19—C18 | 120.1 (6) |
| O2—Dy1—N1 | 118.90 (14) | C21—C20—C19 | 121.2 (6) |
| O1—Dy1—O9 | 124.35 (14) | C21—C20—H20 | 119.4 |
| O6—Dy1—O9 | 105.28 (16) | C19—C20—H20 | 119.4 |
| O5—Dy1—O9 | 67.00 (15) | C20—C21—C16 | 120.9 (7) |
| O10—Dy1—O9 | 49.88 (15) | C20—C21—H21 | 119.5 |
| N4—Dy1—O9 | 66.62 (16) | C16—C21—H21 | 119.5 |
| N3—Dy1—O9 | 112.12 (16) | C23—C22—C19 | 120.2 (6) |
| N2—Dy1—O9 | 112.21 (15) | C23—C22—H22 | 119.9 |
| O2—Dy1—O9 | 174.91 (14) | C19—C22—H22 | 119.9 |
| N1—Dy1—O9 | 66.19 (15) | C22—C23—C24 | 119.2 (6) |
| C25—O1—Dy1 | 97.6 (4) | C22—C23—H23 | 120.4 |
| C25—O2—Dy1 | 92.2 (3) | C24—C23—H23 | 120.4 |
| C27—O3—H27 | 109.5 | N4—C24—C23 | 123.4 (7) |
| C31—O4—H31 | 109.4 | N4—C24—H24 | 118.3 |
| C32—O5—Dy1 | 93.5 (4) | C23—C24—H24 | 118.3 |
| C32—O6—Dy1 | 94.0 (4) | O1—C25—O2 | 118.3 (5) |
| C34—O7—H34 | 109.5 | O1—C25—C26 | 120.4 (5) |
| C38—O8—H38 | 109.5 | O2—C25—C26 | 121.3 (5) |
| N5—O9—Dy1 | 94.6 (3) | C31—C26—C27 | 117.5 (6) |
| N5—O10—Dy1 | 100.3 (4) | C31—C26—C25 | 121.1 (5) |
| C1—N1—C5 | 116.9 (5) | C27—C26—C25 | 121.4 (5) |
| C1—N1—Dy1 | 123.6 (4) | O3—C27—C28 | 118.1 (6) |
| C5—N1—Dy1 | 119.2 (4) | O3—C27—C26 | 121.2 (6) |
| C12—N2—C6 | 117.3 (5) | C28—C27—C26 | 120.7 (6) |
| C12—N2—Dy1 | 122.6 (4) | C29—C28—C27 | 119.7 (6) |
| C6—N2—Dy1 | 119.8 (3) | C29—C28—H28 | 120.2 |
| C13—N3—C17 | 118.1 (6) | C27—C28—H28 | 120.2 |
| C13—N3—Dy1 | 123.0 (4) | C28—C29—C30 | 121.6 (7) |
| C17—N3—Dy1 | 118.1 (4) | C28—C29—H29 | 119.2 |
| C24—N4—C18 | 117.7 (5) | C30—C29—H29 | 119.2 |
| C24—N4—Dy1 | 122.8 (4) | C29—C30—C31 | 119.8 (7) |
| C18—N4—Dy1 | 119.4 (4) | C29—C30—H30 | 120.1 |
| O11—N5—O9 | 123.8 (6) | C31—C30—H30 | 120.1 |
| O11—N5—O10 | 121.0 (6) | O4—C31—C30 | 117.9 (6) |
| O9—N5—O10 | 115.2 (5) | O4—C31—C26 | 121.4 (6) |
| N1—C1—C2 | 124.5 (6) | C30—C31—C26 | 120.7 (6) |
| N1—C1—H1 | 117.8 | O5—C32—O6 | 117.8 (6) |
| C2—C1—H1 | 117.8 | O5—C32—C33 | 121.1 (6) |
| C3—C2—C1 | 118.6 (6) | O6—C32—C33 | 121.0 (6) |
| C3—C2—H2 | 120.7 | C34—C33—C38 | 117.3 (6) |
| C1—C2—H2 | 120.7 | C34—C33—C32 | 121.3 (6) |
| C2—C3—C4 | 119.6 (6) | C38—C33—C32 | 121.3 (6) |
| C2—C3—H3 | 120.2 | O7—C34—C35 | 116.8 (6) |
| C4—C3—H3 | 120.2 | O7—C34—C33 | 121.8 (6) |
| C3—C4—C5 | 117.7 (6) | C35—C34—C33 | 121.4 (6) |
| C3—C4—C9 | 123.0 (6) | C34—C35—C36 | 118.7 (7) |
| C5—C4—C9 | 119.4 (6) | C34—C35—H35 | 120.6 |
| N1—C5—C4 | 122.7 (5) | C36—C35—H35 | 120.6 |
| N1—C5—C6 | 117.4 (5) | C37—C36—C35 | 122.4 (7) |
| C4—C5—C6 | 119.9 (5) | C37—C36—H36 | 118.8 |
| N2—C6—C7 | 122.0 (5) | C35—C36—H36 | 118.8 |
| N2—C6—C5 | 119.1 (5) | C36—C37—C38 | 118.5 (7) |
| C7—C6—C5 | 118.9 (5) | C36—C37—H37 | 120.8 |
| C10—C7—C6 | 117.5 (6) | C38—C37—H37 | 120.8 |
| C10—C7—C8 | 123.5 (6) | O8—C38—C37 | 117.8 (7) |
| C6—C7—C8 | 119.1 (6) | O8—C38—C33 | 120.6 (7) |
| C9—C8—C7 | 121.3 (6) | C37—C38—C33 | 121.7 (7) |
| H··· | ||||
| O3—H27···O1 | 0.82 | 1.86 | 2.577 (7) | 146 |
| O4—H31···O2 | 0.82 | 1.86 | 2.588 (6) | 148 |
| O7—H34···O5 | 0.82 | 1.91 | 2.592 (7) | 139 |
| O8—H38···O6 | 0.82 | 1.84 | 2.570 (7) | 148 |
Selected bond lengths (Å)
| Dy1—N1 | 2.597 (5) |
| Dy1—N2 | 2.556 (4) |
| Dy1—N3 | 2.545 (5) |
| Dy1—N4 | 2.515 (5) |
| Dy1—O1 | 2.442 (4) |
| Dy1—O2 | 2.557 (4) |
| Dy1—O5 | 2.458 (4) |
| Dy1—O6 | 2.444 (5) |
| Dy1—O9 | 2.604 (5) |
| Dy1—O10 | 2.482 (5) |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| O3—H27⋯O1 | 0.82 | 1.86 | 2.577 (7) | 146 |
| O4—H31⋯O2 | 0.82 | 1.86 | 2.588 (6) | 148 |
| O7—H34⋯O5 | 0.82 | 1.91 | 2.592 (7) | 139 |
| O8—H38⋯O6 | 0.82 | 1.84 | 2.570 (7) | 148 |