| Literature DB >> 21754674 |
Xuebin Xu, Shuai Ding, Si Shen, Jinkui Tang, Zhiliang Liu.
Abstract
In the centrosymmetric dinuclear title compound, [Dy(2)(C(15)H(12)N(3)O(2)S)(2)(NO(3))(4)]·2CH(3)OH, the two Dy(III) atoms are coordinated by two deprotonated 2-{[2-(1,3-benzothia-zol-2-yl)hydrazinyl-idene]meth-yl}-6-meth-oxy-phenol ligands and four nitrate ions, all of which are chelating. The crystal packing is stabilized by inter-molecular N-H⋯O hydrogen bonds and weak O-H⋯O inter-actions, forming a two-dimensional network parallel to (010).Entities:
Year: 2011 PMID: 21754674 PMCID: PMC3120308 DOI: 10.1107/S1600536811019118
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Dy2(C15H12N3O2S)2(NO3)4]·2CH4O | |
| Triclinic, | |
| Hall symbol: -P 1 | Mo |
| Cell parameters from 3776 reflections | |
| θ = 2.3–25.1° | |
| µ = 3.92 mm−1 | |
| α = 112.045 (1)° | |
| β = 105.065 (1)° | Block, yellow |
| γ = 93.154 (1)° | 0.20 × 0.10 × 0.10 mm |
| Rigaku Saturn CCD area-detector diffractometer | 3502 independent reflections |
| Radiation source: rotating anode | 3162 reflections with |
| confocal | |
| Detector resolution: 7.31 pixels mm-1 | θmax = 25.1°, θmin = 2.0° |
| ω and φ scans | |
| Absorption correction: multi-scan ( | |
| 5083 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 | |
| 3502 reflections | (Δ/σ)max = 0.001 |
| 292 parameters | Δρmax = 0.83 e Å−3 |
| 0 restraints | Δρmin = −0.51 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 |
| C1 | 0.5488 (5) | −0.1481 (6) | 1.3423 (4) | 0.0419 (12) | |
| H1A | 0.4829 | −0.0989 | 1.3895 | 0.063* | |
| H1B | 0.6488 | −0.0946 | 1.3876 | 0.063* | |
| H1C | 0.5453 | −0.2468 | 1.3387 | 0.063* | |
| C2 | 0.3550 (4) | −0.2085 (4) | 1.1420 (4) | 0.0262 (9) | |
| C3 | 0.2744 (5) | −0.3007 (5) | 1.1704 (4) | 0.0328 (10) | |
| H3 | 0.3194 | −0.3323 | 1.2363 | 0.039* | |
| C4 | 0.1277 (5) | −0.3481 (5) | 1.1034 (4) | 0.0349 (10) | |
| H4 | 0.0711 | −0.4143 | 1.1208 | 0.042* | |
| C5 | 0.0654 (4) | −0.2974 (5) | 1.0113 (4) | 0.0314 (10) | |
| H5 | −0.0365 | −0.3263 | 0.9677 | 0.038* | |
| C6 | 0.1455 (4) | −0.2054 (4) | 0.9789 (4) | 0.0259 (9) | |
| C7 | 0.2972 (4) | −0.1615 (4) | 1.0421 (4) | 0.0237 (8) | |
| C8 | 0.0613 (4) | −0.1613 (5) | 0.8805 (4) | 0.0308 (10) | |
| H8 | −0.0395 | −0.2025 | 0.8423 | 0.037* | |
| C9 | 0.0364 (4) | 0.0701 (5) | 0.7244 (4) | 0.0285 (9) | |
| C10 | 0.1564 (4) | 0.2767 (4) | 0.7467 (4) | 0.0265 (9) | |
| C11 | 0.2636 (4) | 0.3998 (5) | 0.7988 (4) | 0.0309 (10) | |
| H11 | 0.3530 | 0.4075 | 0.8617 | 0.037* | |
| C12 | 0.2378 (5) | 0.5099 (5) | 0.7573 (4) | 0.0335 (10) | |
| H12 | 0.3112 | 0.5930 | 0.7904 | 0.040* | |
| C13 | 0.1059 (5) | 0.5011 (5) | 0.6680 (4) | 0.0354 (10) | |
| H13 | 0.0902 | 0.5791 | 0.6421 | 0.042* | |
| C14 | −0.0026 (5) | 0.3818 (5) | 0.6163 (4) | 0.0335 (10) | |
| H14 | −0.0930 | 0.3764 | 0.5557 | 0.040* | |
| C15 | 0.0251 (4) | 0.2701 (5) | 0.6558 (4) | 0.0284 (9) | |
| C16 | 0.2951 (6) | 0.3287 (6) | 0.4354 (5) | 0.0540 (14) | |
| H16A | 0.2585 | 0.3862 | 0.3858 | 0.081* | |
| H16C | 0.3978 | 0.3682 | 0.4862 | 0.081* | |
| H16B | 0.2374 | 0.3326 | 0.4945 | 0.081* | |
| Dy1 | 0.358298 (18) | 0.05304 (2) | 0.890365 (17) | 0.02346 (8) | |
| N4 | 0.1097 (3) | −0.0726 (4) | 0.8405 (3) | 0.0283 (8) | |
| N5 | 0.1632 (3) | 0.1587 (4) | 0.7829 (3) | 0.0274 (8) | |
| N6 | 0.3542 (4) | 0.3093 (4) | 1.1063 (3) | 0.0345 (9) | |
| N7 | 0.3601 (4) | −0.1898 (4) | 0.6517 (3) | 0.0327 (8) | |
| N9 | 0.0038 (3) | −0.0478 (4) | 0.7456 (3) | 0.0327 (8) | |
| H9 | −0.0802 | −0.1070 | 0.7020 | 0.039* | |
| O1 | 0.5034 (3) | −0.1543 (3) | 1.2102 (3) | 0.0291 (6) | |
| O2 | 0.3863 (3) | −0.0823 (3) | 1.0113 (2) | 0.0249 (6) | |
| O3 | 0.2717 (3) | 0.1897 (3) | 1.0724 (3) | 0.0340 (7) | |
| O4 | 0.4335 (3) | 0.3079 (3) | 1.0330 (3) | 0.0337 (7) | |
| O5 | 0.3585 (4) | 0.4152 (4) | 1.2012 (3) | 0.0574 (10) | |
| O6 | 0.2613 (3) | −0.1127 (3) | 0.6575 (3) | 0.0371 (7) | |
| O7 | 0.3620 (4) | −0.2850 (4) | 0.5512 (3) | 0.0580 (10) | |
| O8 | 0.4579 (3) | −0.1600 (3) | 0.7589 (3) | 0.0416 (8) | |
| O9 | 0.2828 (3) | 0.1836 (4) | 0.3486 (3) | 0.0452 (8) | |
| H9A | 0.3398 | 0.1790 | 0.3038 | 0.068* | |
| S1 | −0.09430 (11) | 0.11034 (12) | 0.61321 (10) | 0.0315 (2) |
| C1 | 0.033 (2) | 0.062 (3) | 0.028 (2) | 0.002 (2) | 0.0030 (19) | 0.020 (2) |
| C2 | 0.021 (2) | 0.029 (2) | 0.027 (2) | 0.0045 (17) | 0.0058 (17) | 0.0110 (18) |
| C3 | 0.036 (2) | 0.029 (2) | 0.033 (2) | 0.006 (2) | 0.0075 (19) | 0.014 (2) |
| C4 | 0.033 (2) | 0.033 (2) | 0.041 (3) | 0.002 (2) | 0.011 (2) | 0.017 (2) |
| C5 | 0.022 (2) | 0.035 (2) | 0.034 (2) | 0.0027 (18) | 0.0075 (18) | 0.011 (2) |
| C6 | 0.0188 (19) | 0.028 (2) | 0.030 (2) | 0.0037 (17) | 0.0051 (17) | 0.0118 (18) |
| C7 | 0.0183 (19) | 0.022 (2) | 0.028 (2) | 0.0031 (16) | 0.0038 (16) | 0.0095 (18) |
| C8 | 0.016 (2) | 0.037 (3) | 0.033 (2) | 0.0030 (18) | 0.0006 (17) | 0.013 (2) |
| C9 | 0.019 (2) | 0.037 (2) | 0.028 (2) | 0.0086 (18) | 0.0036 (17) | 0.013 (2) |
| C10 | 0.023 (2) | 0.032 (2) | 0.024 (2) | 0.0070 (18) | 0.0049 (17) | 0.0117 (18) |
| C11 | 0.022 (2) | 0.039 (3) | 0.030 (2) | 0.0060 (19) | 0.0039 (17) | 0.014 (2) |
| C12 | 0.029 (2) | 0.035 (2) | 0.032 (2) | 0.003 (2) | 0.0046 (19) | 0.012 (2) |
| C13 | 0.039 (2) | 0.039 (3) | 0.031 (2) | 0.011 (2) | 0.006 (2) | 0.019 (2) |
| C14 | 0.031 (2) | 0.042 (3) | 0.028 (2) | 0.012 (2) | 0.0021 (19) | 0.019 (2) |
| C15 | 0.020 (2) | 0.038 (2) | 0.022 (2) | 0.0059 (18) | 0.0028 (16) | 0.0086 (19) |
| C16 | 0.043 (3) | 0.069 (4) | 0.044 (3) | 0.009 (3) | 0.011 (2) | 0.018 (3) |
| Dy1 | 0.01390 (10) | 0.03118 (12) | 0.02375 (11) | 0.00321 (8) | 0.00021 (7) | 0.01318 (9) |
| N4 | 0.0175 (16) | 0.033 (2) | 0.0301 (18) | −0.0005 (15) | −0.0019 (14) | 0.0156 (16) |
| N5 | 0.0207 (17) | 0.0310 (19) | 0.0281 (18) | 0.0054 (15) | 0.0046 (14) | 0.0110 (16) |
| N6 | 0.033 (2) | 0.039 (2) | 0.029 (2) | 0.0144 (18) | 0.0035 (17) | 0.0152 (19) |
| N7 | 0.0199 (18) | 0.036 (2) | 0.031 (2) | 0.0019 (16) | −0.0010 (15) | 0.0067 (18) |
| N9 | 0.0144 (16) | 0.045 (2) | 0.0347 (19) | −0.0018 (16) | −0.0072 (14) | 0.0229 (18) |
| O1 | 0.0195 (13) | 0.0415 (17) | 0.0277 (15) | 0.0034 (13) | 0.0010 (11) | 0.0199 (14) |
| O2 | 0.0146 (13) | 0.0316 (16) | 0.0279 (14) | 0.0016 (12) | 0.0007 (11) | 0.0156 (13) |
| O3 | 0.0291 (16) | 0.0430 (19) | 0.0312 (16) | 0.0091 (15) | 0.0063 (13) | 0.0177 (15) |
| O4 | 0.0285 (15) | 0.0393 (18) | 0.0298 (15) | 0.0044 (14) | 0.0036 (13) | 0.0138 (14) |
| O5 | 0.086 (3) | 0.041 (2) | 0.041 (2) | 0.021 (2) | 0.0250 (19) | 0.0073 (18) |
| O6 | 0.0229 (15) | 0.0449 (19) | 0.0318 (16) | 0.0119 (14) | −0.0016 (13) | 0.0087 (15) |
| O7 | 0.0373 (19) | 0.066 (3) | 0.037 (2) | 0.0132 (18) | −0.0008 (16) | −0.0066 (19) |
| O8 | 0.0351 (17) | 0.0463 (19) | 0.0321 (16) | 0.0152 (15) | −0.0033 (14) | 0.0117 (15) |
| O9 | 0.0258 (17) | 0.057 (2) | 0.046 (2) | −0.0010 (16) | 0.0079 (14) | 0.0163 (18) |
| S1 | 0.0212 (5) | 0.0388 (6) | 0.0302 (5) | 0.0037 (5) | −0.0020 (4) | 0.0161 (5) |
| C1—O1 | 1.459 (5) | C13—H13 | 0.9500 |
| C1—H1A | 0.9800 | C14—C15 | 1.384 (6) |
| C1—H1B | 0.9800 | C14—H14 | 0.9500 |
| C1—H1C | 0.9800 | C15—S1 | 1.752 (4) |
| C2—C3 | 1.364 (6) | C16—O9 | 1.410 (6) |
| C2—O1 | 1.402 (4) | C16—H16A | 0.9800 |
| C2—C7 | 1.410 (5) | C16—H16C | 0.9800 |
| C3—C4 | 1.379 (6) | C16—H16B | 0.9800 |
| C3—H3 | 0.9500 | Dy1—O2 | 2.280 (3) |
| C4—C5 | 1.370 (6) | Dy1—O2i | 2.374 (2) |
| C4—H4 | 0.9500 | Dy1—O1i | 2.394 (3) |
| C5—C6 | 1.390 (5) | Dy1—O4 | 2.422 (3) |
| C5—H5 | 0.9500 | Dy1—O3 | 2.433 (3) |
| C6—C7 | 1.412 (5) | Dy1—N4 | 2.461 (3) |
| C6—C8 | 1.451 (5) | Dy1—O6 | 2.471 (3) |
| C7—O2 | 1.342 (4) | Dy1—N5 | 2.494 (3) |
| C8—N4 | 1.270 (5) | Dy1—O8 | 2.530 (3) |
| C8—H8 | 0.9500 | Dy1—Dy1i | 3.7184 (4) |
| C9—N5 | 1.320 (5) | N4—N9 | 1.402 (4) |
| C9—N9 | 1.340 (5) | N6—O5 | 1.203 (5) |
| C9—S1 | 1.738 (4) | N6—O3 | 1.273 (5) |
| C10—C11 | 1.395 (6) | N6—O4 | 1.279 (4) |
| C10—C15 | 1.399 (5) | N7—O7 | 1.208 (5) |
| C10—N5 | 1.405 (5) | N7—O6 | 1.261 (4) |
| C11—C12 | 1.379 (6) | N7—O8 | 1.266 (4) |
| C11—H11 | 0.9500 | N9—H9 | 0.8800 |
| C12—C13 | 1.388 (6) | O1—Dy1i | 2.394 (3) |
| C12—H12 | 0.9500 | O2—Dy1i | 2.374 (2) |
| C13—C14 | 1.376 (6) | O9—H9A | 0.8400 |
| O1—C1—H1A | 109.5 | O4—Dy1—O3 | 52.63 (10) |
| O1—C1—H1B | 109.5 | O2—Dy1—N4 | 75.53 (10) |
| H1A—C1—H1B | 109.5 | O2i—Dy1—N4 | 149.07 (10) |
| O1—C1—H1C | 109.5 | O1i—Dy1—N4 | 138.80 (10) |
| H1A—C1—H1C | 109.5 | O4—Dy1—N4 | 121.11 (11) |
| H1B—C1—H1C | 109.5 | O3—Dy1—N4 | 74.17 (11) |
| C3—C2—O1 | 122.0 (4) | O2—Dy1—O6 | 108.45 (10) |
| C3—C2—C7 | 123.2 (4) | O2i—Dy1—O6 | 116.45 (9) |
| O1—C2—C7 | 114.8 (3) | O1i—Dy1—O6 | 76.95 (10) |
| C2—C3—C4 | 120.1 (4) | O4—Dy1—O6 | 141.79 (10) |
| C2—C3—H3 | 120.0 | O3—Dy1—O6 | 139.92 (10) |
| C4—C3—H3 | 120.0 | N4—Dy1—O6 | 69.16 (10) |
| C5—C4—C3 | 118.5 (4) | O2—Dy1—N5 | 139.17 (10) |
| C5—C4—H4 | 120.8 | O2i—Dy1—N5 | 144.17 (10) |
| C3—C4—H4 | 120.8 | O1i—Dy1—N5 | 81.46 (10) |
| C4—C5—C6 | 122.6 (4) | O4—Dy1—N5 | 79.22 (10) |
| C4—C5—H5 | 118.7 | O3—Dy1—N5 | 79.08 (10) |
| C6—C5—H5 | 118.7 | N4—Dy1—N5 | 66.52 (11) |
| C5—C6—C7 | 119.6 (4) | O6—Dy1—N5 | 72.05 (10) |
| C5—C6—C8 | 115.0 (4) | O2—Dy1—O8 | 77.32 (10) |
| C7—C6—C8 | 125.3 (4) | O2i—Dy1—O8 | 70.22 (9) |
| O2—C7—C2 | 119.8 (3) | O1i—Dy1—O8 | 76.42 (10) |
| O2—C7—C6 | 124.3 (3) | O4—Dy1—O8 | 140.65 (10) |
| C2—C7—C6 | 115.8 (3) | O3—Dy1—O8 | 153.86 (10) |
| N4—C8—C6 | 126.1 (4) | N4—Dy1—O8 | 98.23 (11) |
| N4—C8—H8 | 117.0 | O6—Dy1—O8 | 50.52 (9) |
| C6—C8—H8 | 117.0 | N5—Dy1—O8 | 121.51 (10) |
| N5—C9—N9 | 123.9 (4) | O2—Dy1—Dy1i | 37.86 (6) |
| N5—C9—S1 | 117.3 (3) | O2i—Dy1—Dy1i | 36.10 (6) |
| N9—C9—S1 | 118.8 (3) | O1i—Dy1—Dy1i | 103.10 (6) |
| C11—C10—C15 | 119.0 (4) | O4—Dy1—Dy1i | 92.27 (7) |
| C11—C10—N5 | 125.8 (3) | O3—Dy1—Dy1i | 90.23 (7) |
| C15—C10—N5 | 115.2 (4) | N4—Dy1—Dy1i | 113.24 (8) |
| C12—C11—C10 | 118.9 (4) | O6—Dy1—Dy1i | 118.59 (7) |
| C12—C11—H11 | 120.6 | N5—Dy1—Dy1i | 169.00 (8) |
| C10—C11—H11 | 120.6 | O8—Dy1—Dy1i | 69.47 (6) |
| C11—C12—C13 | 120.9 (4) | C8—N4—N9 | 114.2 (3) |
| C11—C12—H12 | 119.5 | C8—N4—Dy1 | 131.6 (3) |
| C13—C12—H12 | 119.5 | N9—N4—Dy1 | 114.1 (2) |
| C14—C13—C12 | 121.5 (4) | C9—N5—C10 | 109.1 (3) |
| C14—C13—H13 | 119.3 | C9—N5—Dy1 | 113.1 (3) |
| C12—C13—H13 | 119.3 | C10—N5—Dy1 | 136.6 (2) |
| C13—C14—C15 | 117.4 (4) | O5—N6—O3 | 122.4 (4) |
| C13—C14—H14 | 121.3 | O5—N6—O4 | 122.6 (4) |
| C15—C14—H14 | 121.3 | O3—N6—O4 | 115.0 (3) |
| C14—C15—C10 | 122.3 (4) | O7—N7—O6 | 122.5 (4) |
| C14—C15—S1 | 127.6 (3) | O7—N7—O8 | 122.2 (4) |
| C10—C15—S1 | 109.9 (3) | O6—N7—O8 | 115.2 (3) |
| O9—C16—H16A | 109.5 | C9—N9—N4 | 117.0 (3) |
| O9—C16—H16C | 109.5 | C9—N9—H9 | 121.5 |
| H16A—C16—H16C | 109.5 | N4—N9—H9 | 121.5 |
| O9—C16—H16B | 109.5 | C2—O1—C1 | 114.9 (3) |
| H16A—C16—H16B | 109.5 | C2—O1—Dy1i | 116.7 (2) |
| H16C—C16—H16B | 109.5 | C1—O1—Dy1i | 127.7 (2) |
| O2—Dy1—O2i | 73.96 (10) | C7—O2—Dy1 | 136.2 (2) |
| O2—Dy1—O1i | 139.27 (9) | C7—O2—Dy1i | 117.7 (2) |
| O2i—Dy1—O1i | 68.12 (9) | Dy1—O2—Dy1i | 106.04 (10) |
| O2—Dy1—O4 | 109.76 (9) | N6—O3—Dy1 | 95.9 (2) |
| O2i—Dy1—O4 | 74.78 (9) | N6—O4—Dy1 | 96.3 (2) |
| O1i—Dy1—O4 | 74.29 (10) | N7—O6—Dy1 | 98.6 (2) |
| O2—Dy1—O3 | 76.56 (10) | N7—O8—Dy1 | 95.6 (2) |
| O2i—Dy1—O3 | 103.27 (9) | C16—O9—H9A | 109.5 |
| O1i—Dy1—O3 | 125.83 (10) | C9—S1—C15 | 88.36 (19) |
| O1—C2—C3—C4 | 178.1 (4) | C8—N4—N9—C9 | 162.8 (4) |
| C7—C2—C3—C4 | −2.5 (7) | Dy1—N4—N9—C9 | −20.4 (4) |
| C2—C3—C4—C5 | −1.7 (6) | C3—C2—O1—C1 | −25.7 (5) |
| C3—C4—C5—C6 | 2.8 (7) | C7—C2—O1—C1 | 154.9 (4) |
| C4—C5—C6—C7 | 0.2 (6) | C3—C2—O1—Dy1i | 162.7 (3) |
| C4—C5—C6—C8 | −179.3 (4) | C7—C2—O1—Dy1i | −16.7 (4) |
| C3—C2—C7—O2 | −173.5 (4) | C2—C7—O2—Dy1 | −167.5 (3) |
| O1—C2—C7—O2 | 6.0 (5) | C6—C7—O2—Dy1 | 13.8 (6) |
| C3—C2—C7—C6 | 5.3 (6) | C2—C7—O2—Dy1i | 7.9 (5) |
| O1—C2—C7—C6 | −175.2 (3) | C6—C7—O2—Dy1i | −170.8 (3) |
| C5—C6—C7—O2 | 174.7 (4) | O2i—Dy1—O2—C7 | 175.7 (4) |
| C8—C6—C7—O2 | −6.0 (6) | O1i—Dy1—O2—C7 | −162.4 (3) |
| C5—C6—C7—C2 | −4.1 (6) | O4—Dy1—O2—C7 | 108.9 (3) |
| C8—C6—C7—C2 | 175.3 (4) | O3—Dy1—O2—C7 | 67.4 (3) |
| C5—C6—C8—N4 | 176.4 (4) | N4—Dy1—O2—C7 | −9.4 (3) |
| C7—C6—C8—N4 | −3.0 (7) | O6—Dy1—O2—C7 | −71.2 (3) |
| C15—C10—C11—C12 | −1.1 (6) | N5—Dy1—O2—C7 | 12.5 (4) |
| N5—C10—C11—C12 | −176.9 (4) | O8—Dy1—O2—C7 | −111.5 (3) |
| C10—C11—C12—C13 | 1.8 (6) | Dy1i—Dy1—O2—C7 | 175.7 (4) |
| C11—C12—C13—C14 | −1.0 (7) | O2i—Dy1—O2—Dy1i | 0.0 |
| C12—C13—C14—C15 | −0.5 (6) | O1i—Dy1—O2—Dy1i | 21.83 (19) |
| C13—C14—C15—C10 | 1.2 (6) | O4—Dy1—O2—Dy1i | −66.82 (12) |
| C13—C14—C15—S1 | 176.6 (3) | O3—Dy1—O2—Dy1i | −108.32 (12) |
| C11—C10—C15—C14 | −0.5 (6) | N4—Dy1—O2—Dy1i | 174.87 (13) |
| N5—C10—C15—C14 | 175.8 (4) | O6—Dy1—O2—Dy1i | 113.12 (11) |
| C11—C10—C15—S1 | −176.5 (3) | N5—Dy1—O2—Dy1i | −163.24 (12) |
| N5—C10—C15—S1 | −0.2 (4) | O8—Dy1—O2—Dy1i | 72.77 (11) |
| C6—C8—N4—N9 | −179.2 (4) | O5—N6—O3—Dy1 | −175.9 (4) |
| C6—C8—N4—Dy1 | 4.8 (7) | O4—N6—O3—Dy1 | 3.2 (3) |
| O2—Dy1—N4—C8 | 0.1 (4) | O2—Dy1—O3—N6 | 126.4 (2) |
| O2i—Dy1—N4—C8 | 9.7 (5) | O2i—Dy1—O3—N6 | 56.8 (2) |
| O1i—Dy1—N4—C8 | 153.4 (3) | O1i—Dy1—O3—N6 | −15.6 (2) |
| O4—Dy1—N4—C8 | −104.5 (4) | O4—Dy1—O3—N6 | −1.92 (19) |
| O3—Dy1—N4—C8 | −79.8 (4) | N4—Dy1—O3—N6 | −155.1 (2) |
| O6—Dy1—N4—C8 | 116.7 (4) | O6—Dy1—O3—N6 | −130.8 (2) |
| N5—Dy1—N4—C8 | −164.5 (4) | N5—Dy1—O3—N6 | −86.6 (2) |
| O8—Dy1—N4—C8 | 74.6 (4) | O8—Dy1—O3—N6 | 128.8 (3) |
| Dy1i—Dy1—N4—C8 | 3.5 (4) | Dy1i—Dy1—O3—N6 | 90.8 (2) |
| O2—Dy1—N4—N9 | −176.0 (3) | O5—N6—O4—Dy1 | 175.9 (4) |
| O2i—Dy1—N4—N9 | −166.4 (2) | O3—N6—O4—Dy1 | −3.2 (3) |
| O1i—Dy1—N4—N9 | −22.7 (3) | O2—Dy1—O4—N6 | −52.3 (2) |
| O4—Dy1—N4—N9 | 79.4 (3) | O2i—Dy1—O4—N6 | −118.6 (2) |
| O3—Dy1—N4—N9 | 104.2 (3) | O1i—Dy1—O4—N6 | 170.4 (2) |
| O6—Dy1—N4—N9 | −59.4 (3) | O3—Dy1—O4—N6 | 1.91 (19) |
| N5—Dy1—N4—N9 | 19.4 (2) | N4—Dy1—O4—N6 | 32.4 (2) |
| O8—Dy1—N4—N9 | −101.4 (3) | O6—Dy1—O4—N6 | 127.8 (2) |
| Dy1i—Dy1—N4—N9 | −172.6 (2) | N5—Dy1—O4—N6 | 86.3 (2) |
| N9—C9—N5—C10 | −175.2 (4) | O8—Dy1—O4—N6 | −146.3 (2) |
| S1—C9—N5—C10 | 5.1 (4) | Dy1i—Dy1—O4—N6 | −86.6 (2) |
| N9—C9—N5—Dy1 | 15.4 (5) | O7—N7—O6—Dy1 | −176.6 (4) |
| S1—C9—N5—Dy1 | −164.29 (19) | O8—N7—O6—Dy1 | 3.1 (4) |
| C11—C10—N5—C9 | 173.0 (4) | O2—Dy1—O6—N7 | −56.8 (2) |
| C15—C10—N5—C9 | −3.0 (5) | O2i—Dy1—O6—N7 | 24.1 (3) |
| C11—C10—N5—Dy1 | −21.3 (6) | O1i—Dy1—O6—N7 | 81.2 (2) |
| C15—C10—N5—Dy1 | 162.7 (3) | O4—Dy1—O6—N7 | 123.1 (2) |
| O2—Dy1—N5—C9 | −40.9 (3) | O3—Dy1—O6—N7 | −147.7 (2) |
| O2i—Dy1—N5—C9 | 167.3 (2) | N4—Dy1—O6—N7 | −122.6 (2) |
| O1i—Dy1—N5—C9 | 135.7 (3) | N5—Dy1—O6—N7 | 166.3 (3) |
| O4—Dy1—N5—C9 | −148.7 (3) | O8—Dy1—O6—N7 | −1.8 (2) |
| O3—Dy1—N5—C9 | −95.1 (3) | Dy1i—Dy1—O6—N7 | −16.8 (2) |
| N4—Dy1—N5—C9 | −17.7 (3) | O7—N7—O8—Dy1 | 176.7 (4) |
| O6—Dy1—N5—C9 | 56.8 (3) | O6—N7—O8—Dy1 | −3.0 (4) |
| O8—Dy1—N5—C9 | 67.5 (3) | O2—Dy1—O8—N7 | 129.1 (2) |
| Dy1i—Dy1—N5—C9 | −108.9 (4) | O2i—Dy1—O8—N7 | −153.6 (3) |
| O2—Dy1—N5—C10 | 153.8 (3) | O1i—Dy1—O8—N7 | −82.3 (2) |
| O2i—Dy1—N5—C10 | 2.0 (5) | O4—Dy1—O8—N7 | −125.1 (2) |
| O1i—Dy1—N5—C10 | −29.6 (4) | O3—Dy1—O8—N7 | 126.7 (3) |
| O4—Dy1—N5—C10 | 46.0 (4) | N4—Dy1—O8—N7 | 56.0 (2) |
| O3—Dy1—N5—C10 | 99.6 (4) | O6—Dy1—O8—N7 | 1.8 (2) |
| N4—Dy1—N5—C10 | 177.0 (4) | N5—Dy1—O8—N7 | −11.4 (3) |
| O6—Dy1—N5—C10 | −108.5 (4) | Dy1i—Dy1—O8—N7 | 167.8 (3) |
| O8—Dy1—N5—C10 | −97.8 (4) | N5—C9—S1—C15 | −4.6 (3) |
| Dy1i—Dy1—N5—C10 | 85.8 (5) | N9—C9—S1—C15 | 175.7 (4) |
| N5—C9—N9—N4 | 3.2 (6) | C14—C15—S1—C9 | −173.3 (4) |
| S1—C9—N9—N4 | −177.1 (3) | C10—C15—S1—C9 | 2.4 (3) |
| H··· | ||||
| O9—H9A···O3ii | 0.84 | 2.64 | 3.206 (4) | 126 |
| O9—H9A···O8iii | 0.84 | 2.24 | 3.049 (4) | 161 |
| N9—H9···O9iv | 0.88 | 1.91 | 2.751 (4) | 160 |
Selected bond lengths (Å)
| Dy1—O2 | 2.280 (3) |
| Dy1—O2i | 2.374 (2) |
| Dy1—O1i | 2.394 (3) |
| Dy1—O4 | 2.422 (3) |
| Dy1—O3 | 2.433 (3) |
| Dy1—N4 | 2.461 (3) |
| Dy1—O6 | 2.471 (3) |
| Dy1—N5 | 2.494 (3) |
| Dy1—O8 | 2.530 (3) |
Symmetry code: (i) .
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| O9—H9 | 0.84 | 2.64 | 3.206 (4) | 126 |
| O9—H9 | 0.84 | 2.24 | 3.049 (4) | 161 |
| N9—H9⋯O9iv | 0.88 | 1.91 | 2.751 (4) | 160 |
Symmetry codes: (ii) ; (iii) ; (iv) .