| Literature DB >> 22058837 |
Fan Yang1, Guang-Ming Li, Peng Chen, Peng-Fei Yan, Guang-Feng Hou.
Abstract
In the heterodinuclear title complex, [GdZn(C(22)H(18)N(2)O(4))(CH(3)COO)(3)], the Zn(II) ion is five-coordinated in a square-pyramidal environment defined by two O atoms and two N atoms from the ligand, forming the square plane, and one acetate O atom serving as the apex, while the Gd(III) ion is nine-coordinated in an approximate mono-capped tetra-gonal-anti-prismatic environment defined by four O atoms from the ligand and five acetate O atoms.Entities:
Year: 2011 PMID: 22058837 PMCID: PMC3200867 DOI: 10.1107/S160053681102890X
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [GdZn(C22H18N2O4)(C2H3O2)3] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 16409 reflections |
| θ = 3.0–27.5° | |
| µ = 3.21 mm−1 | |
| β = 103.65 (3)° | Block, yellow |
| 0.15 × 0.14 × 0.13 mm | |
| Rigaku R-AXIS RAPID diffractometer | 6488 independent reflections |
| Radiation source: fine-focus sealed tube | 4513 reflections with |
| graphite | |
| ω scan | θmax = 27.5°, θmin = 3.0° |
| Absorption correction: multi-scan ( | |
| 26483 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 | |
| 6488 reflections | (Δ/σ)max < 0.001 |
| 384 parameters | Δρmax = 0.59 e Å−3 |
| 0 restraints | Δρmin = −0.82 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 |
| Gd1 | 0.298502 (17) | 0.880640 (16) | 0.188340 (16) | 0.03607 (7) | |
| Zn1 | 0.05908 (4) | 0.84037 (4) | 0.19232 (4) | 0.03815 (14) | |
| O1 | 0.4228 (3) | 0.9767 (3) | 0.2964 (3) | 0.0660 (12) | |
| O2 | 0.4373 (3) | 0.8188 (3) | 0.3022 (3) | 0.0696 (12) | |
| O3 | 0.1371 (2) | 0.9446 (2) | 0.1482 (2) | 0.0457 (8) | |
| O4 | 0.2720 (3) | 1.0662 (2) | 0.1405 (2) | 0.0469 (8) | |
| O5 | 0.2482 (3) | 0.8884 (4) | 0.3247 (3) | 0.0844 (14) | |
| O6 | 0.1715 (2) | 0.7605 (2) | 0.1712 (2) | 0.0448 (9) | |
| O7 | 0.3403 (2) | 0.6960 (2) | 0.1719 (2) | 0.0459 (9) | |
| O8 | 0.2722 (3) | 0.8700 (3) | 0.0262 (2) | 0.0581 (10) | |
| O9 | 0.4224 (3) | 0.8956 (3) | 0.1017 (3) | 0.0594 (10) | |
| O10 | 0.0909 (3) | 0.8682 (2) | 0.3216 (2) | 0.0495 (9) | |
| N1 | −0.0301 (3) | 0.7181 (3) | 0.1660 (3) | 0.0426 (10) | |
| N2 | −0.0693 (3) | 0.9076 (3) | 0.1312 (3) | 0.0406 (9) | |
| C1 | −0.2061 (4) | 0.6805 (5) | 0.1540 (4) | 0.0594 (15) | |
| H1A | −0.1919 | 0.6148 | 0.1686 | 0.071* | |
| C2 | −0.3228 (4) | 0.8097 (6) | 0.1166 (4) | 0.0722 (18) | |
| H2A | −0.3877 | 0.8308 | 0.1047 | 0.087* | |
| C3 | 0.1527 (5) | 1.1987 (3) | 0.0881 (3) | 0.0528 (14) | |
| H3A | 0.2012 | 1.2443 | 0.0847 | 0.063* | |
| C4 | −0.0760 (4) | 0.9959 (3) | 0.0987 (3) | 0.0441 (12) | |
| H4A | −0.1388 | 1.0190 | 0.0729 | 0.053* | |
| C5 | 0.4366 (4) | 0.6643 (4) | 0.1674 (5) | 0.0705 (18) | |
| H5A | 0.4329 | 0.6302 | 0.1122 | 0.106* | |
| H5B | 0.4626 | 0.6208 | 0.2164 | 0.106* | |
| H5C | 0.4788 | 0.7205 | 0.1707 | 0.106* | |
| C6 | 0.5288 (6) | 0.9052 (5) | 0.4231 (4) | 0.095 (3) | |
| H6A | 0.5924 | 0.8835 | 0.4180 | 0.142* | |
| H6B | 0.5060 | 0.8634 | 0.4642 | 0.142* | |
| H6C | 0.5331 | 0.9718 | 0.4445 | 0.142* | |
| C7 | −0.3015 (5) | 0.7124 (5) | 0.1369 (4) | 0.0728 (18) | |
| H7A | −0.3517 | 0.6683 | 0.1390 | 0.087* | |
| C8 | 0.2713 (4) | 0.6248 (3) | 0.1765 (3) | 0.0399 (11) | |
| C9 | 0.0535 (5) | 1.2258 (4) | 0.0651 (4) | 0.0602 (16) | |
| H9A | 0.0361 | 1.2898 | 0.0466 | 0.072* | |
| C10 | 0.1059 (4) | 1.0339 (3) | 0.1223 (3) | 0.0373 (11) | |
| C11 | −0.0183 (4) | 1.1587 (4) | 0.0697 (4) | 0.0550 (15) | |
| H11A | −0.0838 | 1.1777 | 0.0532 | 0.066* | |
| C12 | 0.1196 (5) | 0.4954 (3) | 0.1731 (4) | 0.0541 (14) | |
| H12A | 0.0680 | 0.4512 | 0.1691 | 0.065* | |
| C13 | 0.3513 (4) | 1.1311 (4) | 0.1360 (4) | 0.0594 (15) | |
| H13A | 0.3416 | 1.1567 | 0.0765 | 0.089* | |
| H13B | 0.4122 | 1.0956 | 0.1513 | 0.089* | |
| H13C | 0.3531 | 1.1845 | 0.1771 | 0.089* | |
| C14 | −0.1514 (4) | 0.8451 (4) | 0.1298 (3) | 0.0459 (12) | |
| C15 | 0.0052 (4) | 1.0620 (3) | 0.0987 (3) | 0.0426 (12) | |
| C16 | 0.2889 (4) | 0.5246 (3) | 0.1824 (3) | 0.0512 (13) | |
| H16A | 0.3522 | 0.5005 | 0.1880 | 0.061* | |
| C17 | −0.2486 (4) | 0.8776 (5) | 0.1134 (4) | 0.0600 (14) | |
| H17A | −0.2638 | 0.9435 | 0.1005 | 0.072* | |
| C18 | 0.1774 (4) | 1.1038 (3) | 0.1156 (3) | 0.0395 (11) | |
| C19 | −0.1301 (4) | 0.7453 (4) | 0.1496 (3) | 0.0457 (12) | |
| C20 | 0.0996 (4) | 0.5986 (3) | 0.1719 (3) | 0.0424 (12) | |
| C21 | −0.0006 (4) | 0.6290 (4) | 0.1625 (3) | 0.0510 (13) | |
| H21A | −0.0482 | 0.5798 | 0.1531 | 0.061* | |
| C22 | 0.3616 (4) | 0.8806 (4) | 0.0284 (4) | 0.0524 (13) | |
| C23 | 0.4599 (4) | 0.9003 (4) | 0.3355 (4) | 0.0498 (13) | |
| C24 | 0.2012 (5) | 0.8960 (5) | 0.4602 (4) | 0.0749 (18) | |
| H24A | 0.2498 | 0.9466 | 0.4778 | 0.112* | |
| H24B | 0.2257 | 0.8352 | 0.4886 | 0.112* | |
| H24C | 0.1423 | 0.9144 | 0.4777 | 0.112* | |
| C25 | 0.2112 (5) | 0.4601 (4) | 0.1798 (4) | 0.0632 (16) | |
| H25A | 0.2223 | 0.3925 | 0.1827 | 0.076* | |
| C26 | 0.1791 (4) | 0.8833 (4) | 0.3610 (3) | 0.0516 (13) | |
| C27 | 0.1785 (4) | 0.6639 (3) | 0.1738 (3) | 0.0385 (11) | |
| C28 | 0.3968 (5) | 0.8751 (5) | −0.0560 (4) | 0.084 (2) | |
| H28A | 0.4423 | 0.9277 | −0.0570 | 0.125* | |
| H28B | 0.3419 | 0.8811 | −0.1064 | 0.125* | |
| H28C | 0.4289 | 0.8131 | −0.0586 | 0.125* |
| Gd1 | 0.02645 (12) | 0.03976 (12) | 0.04177 (14) | −0.00167 (10) | 0.00757 (9) | −0.00027 (11) |
| Zn1 | 0.0263 (3) | 0.0438 (3) | 0.0441 (3) | 0.0004 (2) | 0.0079 (2) | −0.0002 (2) |
| O1 | 0.071 (3) | 0.054 (2) | 0.065 (3) | −0.028 (2) | 0.000 (2) | 0.0017 (19) |
| O2 | 0.068 (3) | 0.062 (2) | 0.064 (3) | 0.008 (2) | −0.014 (2) | −0.0066 (19) |
| O3 | 0.030 (2) | 0.0417 (18) | 0.065 (2) | 0.0033 (14) | 0.0124 (17) | 0.0161 (15) |
| O4 | 0.041 (2) | 0.0432 (18) | 0.057 (2) | −0.0066 (15) | 0.0117 (17) | 0.0041 (15) |
| O5 | 0.045 (3) | 0.166 (4) | 0.044 (2) | −0.021 (3) | 0.014 (2) | −0.010 (3) |
| O6 | 0.034 (2) | 0.0337 (18) | 0.070 (3) | −0.0015 (14) | 0.0186 (18) | −0.0013 (15) |
| O7 | 0.0256 (19) | 0.0440 (18) | 0.066 (2) | 0.0072 (14) | 0.0074 (16) | −0.0030 (15) |
| O8 | 0.041 (2) | 0.090 (3) | 0.044 (2) | 0.004 (2) | 0.0114 (17) | −0.0026 (18) |
| O9 | 0.036 (2) | 0.087 (3) | 0.057 (3) | −0.0017 (19) | 0.0137 (19) | 0.001 (2) |
| O10 | 0.036 (2) | 0.070 (2) | 0.043 (2) | 0.0000 (17) | 0.0112 (16) | 0.0014 (16) |
| N1 | 0.031 (2) | 0.054 (2) | 0.044 (3) | −0.0075 (18) | 0.0116 (19) | −0.0008 (18) |
| N2 | 0.033 (2) | 0.051 (2) | 0.037 (2) | 0.0069 (17) | 0.0061 (18) | −0.0012 (17) |
| C1 | 0.041 (4) | 0.088 (4) | 0.051 (4) | −0.013 (3) | 0.016 (3) | 0.000 (3) |
| C2 | 0.022 (3) | 0.134 (6) | 0.061 (4) | −0.009 (3) | 0.010 (3) | −0.007 (4) |
| C3 | 0.070 (4) | 0.039 (3) | 0.047 (3) | 0.000 (3) | 0.008 (3) | 0.002 (2) |
| C4 | 0.034 (3) | 0.062 (3) | 0.036 (3) | 0.017 (2) | 0.008 (2) | −0.005 (2) |
| C5 | 0.028 (3) | 0.069 (4) | 0.112 (6) | 0.011 (3) | 0.014 (3) | −0.010 (3) |
| C6 | 0.096 (6) | 0.110 (5) | 0.064 (5) | −0.045 (5) | −0.008 (4) | −0.005 (4) |
| C7 | 0.040 (4) | 0.110 (5) | 0.068 (5) | −0.022 (3) | 0.012 (3) | 0.000 (4) |
| C8 | 0.046 (3) | 0.036 (2) | 0.036 (3) | 0.001 (2) | 0.007 (2) | −0.0035 (19) |
| C9 | 0.078 (5) | 0.038 (3) | 0.060 (4) | 0.014 (3) | 0.008 (3) | 0.001 (2) |
| C10 | 0.040 (3) | 0.038 (2) | 0.032 (3) | 0.006 (2) | 0.007 (2) | −0.0005 (18) |
| C11 | 0.050 (4) | 0.050 (3) | 0.058 (4) | 0.017 (3) | 0.000 (3) | −0.002 (2) |
| C12 | 0.067 (4) | 0.041 (3) | 0.057 (4) | −0.011 (3) | 0.020 (3) | 0.001 (2) |
| C13 | 0.051 (4) | 0.063 (3) | 0.063 (4) | −0.017 (3) | 0.010 (3) | 0.012 (3) |
| C14 | 0.028 (3) | 0.069 (3) | 0.039 (3) | −0.001 (2) | 0.005 (2) | −0.005 (2) |
| C15 | 0.042 (3) | 0.048 (3) | 0.036 (3) | 0.011 (2) | 0.005 (2) | −0.002 (2) |
| C16 | 0.058 (4) | 0.046 (3) | 0.050 (3) | 0.015 (3) | 0.014 (3) | 0.006 (2) |
| C17 | 0.038 (3) | 0.090 (4) | 0.050 (3) | 0.007 (3) | 0.007 (3) | −0.002 (3) |
| C18 | 0.045 (3) | 0.040 (3) | 0.031 (3) | 0.004 (2) | 0.006 (2) | −0.0037 (18) |
| C19 | 0.029 (3) | 0.066 (3) | 0.041 (3) | −0.010 (2) | 0.007 (2) | −0.004 (2) |
| C20 | 0.050 (3) | 0.041 (3) | 0.038 (3) | −0.005 (2) | 0.016 (2) | 0.0008 (19) |
| C21 | 0.054 (4) | 0.051 (3) | 0.051 (3) | −0.017 (3) | 0.018 (3) | 0.000 (2) |
| C22 | 0.046 (3) | 0.059 (3) | 0.056 (4) | 0.009 (3) | 0.020 (3) | 0.002 (3) |
| C23 | 0.036 (3) | 0.066 (4) | 0.047 (3) | −0.015 (3) | 0.008 (2) | 0.002 (3) |
| C24 | 0.067 (5) | 0.114 (5) | 0.043 (4) | −0.003 (4) | 0.011 (3) | −0.002 (3) |
| C25 | 0.079 (5) | 0.041 (3) | 0.071 (4) | 0.004 (3) | 0.019 (4) | 0.006 (3) |
| C26 | 0.049 (4) | 0.066 (3) | 0.038 (3) | 0.001 (3) | 0.006 (3) | −0.001 (2) |
| C27 | 0.044 (3) | 0.035 (2) | 0.038 (3) | −0.001 (2) | 0.013 (2) | 0.0001 (19) |
| C28 | 0.078 (5) | 0.120 (5) | 0.061 (4) | 0.023 (4) | 0.032 (4) | −0.006 (4) |
| Gd1—O3 | 2.365 (3) | C4—C15 | 1.449 (7) |
| Gd1—O5 | 2.373 (4) | C4—H4A | 0.9300 |
| Gd1—O6 | 2.382 (3) | C5—H5A | 0.9600 |
| Gd1—O9 | 2.436 (4) | C5—H5B | 0.9600 |
| Gd1—O2 | 2.441 (4) | C5—H5C | 0.9600 |
| Gd1—O8 | 2.445 (4) | C6—C23 | 1.465 (8) |
| Gd1—O1 | 2.479 (4) | C6—H6A | 0.9600 |
| Gd1—O7 | 2.601 (3) | C6—H6B | 0.9600 |
| Gd1—O4 | 2.627 (3) | C6—H6C | 0.9600 |
| Gd1—C22 | 2.810 (6) | C7—H7A | 0.9300 |
| Gd1—C23 | 2.814 (5) | C8—C16 | 1.382 (6) |
| Gd1—Zn1 | 3.4139 (9) | C8—C27 | 1.395 (6) |
| Zn1—O10 | 1.975 (3) | C9—C11 | 1.371 (8) |
| Zn1—O6 | 2.002 (3) | C9—H9A | 0.9300 |
| Zn1—O3 | 2.003 (3) | C10—C18 | 1.402 (6) |
| Zn1—N2 | 2.039 (4) | C10—C15 | 1.425 (6) |
| Zn1—N1 | 2.060 (4) | C11—C15 | 1.401 (6) |
| O1—C23 | 1.250 (6) | C11—H11A | 0.9300 |
| O2—C23 | 1.230 (6) | C12—C25 | 1.351 (8) |
| O3—C10 | 1.319 (5) | C12—C20 | 1.429 (6) |
| O4—C18 | 1.387 (6) | C12—H12A | 0.9300 |
| O4—C13 | 1.434 (6) | C13—H13A | 0.9600 |
| O5—C26 | 1.230 (7) | C13—H13B | 0.9600 |
| O6—C27 | 1.315 (5) | C13—H13C | 0.9600 |
| O7—C8 | 1.382 (5) | C14—C17 | 1.397 (7) |
| O7—C5 | 1.433 (6) | C14—C19 | 1.406 (7) |
| O8—C22 | 1.253 (6) | C16—C25 | 1.390 (8) |
| O9—C22 | 1.261 (6) | C16—H16A | 0.9300 |
| O10—C26 | 1.259 (6) | C17—H17A | 0.9300 |
| N1—C21 | 1.284 (6) | C20—C27 | 1.413 (6) |
| N1—C19 | 1.413 (6) | C20—C21 | 1.438 (7) |
| N2—C4 | 1.295 (6) | C21—H21A | 0.9300 |
| N2—C14 | 1.427 (6) | C22—C28 | 1.499 (8) |
| C1—C7 | 1.370 (8) | C24—C26 | 1.498 (7) |
| C1—C19 | 1.396 (7) | C24—H24A | 0.9600 |
| C1—H1A | 0.9300 | C24—H24B | 0.9600 |
| C2—C7 | 1.375 (8) | C24—H24C | 0.9600 |
| C2—C17 | 1.398 (8) | C25—H25A | 0.9300 |
| C2—H2A | 0.9300 | C28—H28A | 0.9600 |
| C3—C18 | 1.376 (6) | C28—H28B | 0.9600 |
| C3—C9 | 1.400 (8) | C28—H28C | 0.9600 |
| C3—H3A | 0.9300 | ||
| O3—Gd1—O5 | 75.50 (14) | C7—C1—C19 | 120.8 (6) |
| O3—Gd1—O6 | 65.12 (10) | C7—C1—H1A | 119.6 |
| O5—Gd1—O6 | 76.04 (13) | C19—C1—H1A | 119.6 |
| O3—Gd1—O9 | 125.94 (12) | C7—C2—C17 | 121.3 (6) |
| O5—Gd1—O9 | 151.85 (14) | C7—C2—H2A | 119.4 |
| O6—Gd1—O9 | 127.31 (12) | C17—C2—H2A | 119.4 |
| O3—Gd1—O2 | 149.88 (14) | C18—C3—C9 | 119.1 (5) |
| O5—Gd1—O2 | 74.38 (16) | C18—C3—H3A | 120.4 |
| O6—Gd1—O2 | 106.97 (12) | C9—C3—H3A | 120.4 |
| O9—Gd1—O2 | 82.74 (14) | N2—C4—C15 | 126.0 (4) |
| O3—Gd1—O8 | 81.38 (13) | N2—C4—H4A | 117.0 |
| O5—Gd1—O8 | 154.78 (14) | C15—C4—H4A | 117.0 |
| O6—Gd1—O8 | 85.25 (12) | O7—C5—H5A | 109.5 |
| O9—Gd1—O8 | 53.03 (13) | O7—C5—H5B | 109.5 |
| O2—Gd1—O8 | 128.15 (14) | H5A—C5—H5B | 109.5 |
| O3—Gd1—O1 | 117.37 (13) | O7—C5—H5C | 109.5 |
| O5—Gd1—O1 | 71.90 (14) | H5A—C5—H5C | 109.5 |
| O6—Gd1—O1 | 145.40 (12) | H5B—C5—H5C | 109.5 |
| O9—Gd1—O1 | 81.16 (13) | C23—C6—H6A | 109.5 |
| O2—Gd1—O1 | 51.91 (13) | C23—C6—H6B | 109.5 |
| O8—Gd1—O1 | 129.16 (13) | H6A—C6—H6B | 109.5 |
| O3—Gd1—O7 | 123.52 (10) | C23—C6—H6C | 109.5 |
| O5—Gd1—O7 | 104.50 (14) | H6A—C6—H6C | 109.5 |
| O6—Gd1—O7 | 60.56 (10) | H6B—C6—H6C | 109.5 |
| O9—Gd1—O7 | 79.67 (12) | C1—C7—C2 | 119.8 (6) |
| O2—Gd1—O7 | 65.11 (11) | C1—C7—H7A | 120.1 |
| O8—Gd1—O7 | 79.98 (11) | C2—C7—H7A | 120.1 |
| O1—Gd1—O7 | 115.73 (12) | O7—C8—C16 | 125.2 (5) |
| O3—Gd1—O4 | 60.72 (10) | O7—C8—C27 | 113.0 (4) |
| O5—Gd1—O4 | 98.87 (14) | C16—C8—C27 | 121.8 (5) |
| O6—Gd1—O4 | 124.96 (11) | C11—C9—C3 | 120.6 (5) |
| O9—Gd1—O4 | 80.67 (12) | C11—C9—H9A | 119.7 |
| O2—Gd1—O4 | 124.60 (12) | C3—C9—H9A | 119.7 |
| O8—Gd1—O4 | 78.02 (11) | O3—C10—C18 | 117.0 (4) |
| O1—Gd1—O4 | 73.41 (12) | O3—C10—C15 | 124.1 (4) |
| O7—Gd1—O4 | 156.55 (11) | C18—C10—C15 | 118.8 (4) |
| O3—Gd1—C22 | 104.47 (14) | C9—C11—C15 | 121.3 (5) |
| O5—Gd1—C22 | 177.28 (16) | C9—C11—H11A | 119.3 |
| O6—Gd1—C22 | 106.46 (15) | C15—C11—H11A | 119.3 |
| O9—Gd1—C22 | 26.62 (14) | C25—C12—C20 | 121.9 (5) |
| O2—Gd1—C22 | 105.62 (16) | C25—C12—H12A | 119.0 |
| O8—Gd1—C22 | 26.43 (14) | C20—C12—H12A | 119.0 |
| O1—Gd1—C22 | 105.89 (16) | O4—C13—H13A | 109.5 |
| O7—Gd1—C22 | 77.82 (13) | O4—C13—H13B | 109.5 |
| O4—Gd1—C22 | 78.86 (13) | H13A—C13—H13B | 109.5 |
| O3—Gd1—C23 | 135.50 (14) | O4—C13—H13C | 109.5 |
| O5—Gd1—C23 | 68.36 (15) | H13A—C13—H13C | 109.5 |
| O6—Gd1—C23 | 126.30 (13) | H13B—C13—H13C | 109.5 |
| O9—Gd1—C23 | 83.90 (14) | C17—C14—C19 | 119.5 (5) |
| O2—Gd1—C23 | 25.85 (13) | C17—C14—N2 | 124.3 (5) |
| O8—Gd1—C23 | 136.84 (14) | C19—C14—N2 | 116.2 (4) |
| O1—Gd1—C23 | 26.35 (12) | C11—C15—C10 | 118.4 (5) |
| O7—Gd1—C23 | 90.78 (13) | C11—C15—C4 | 117.1 (5) |
| O4—Gd1—C23 | 99.73 (13) | C10—C15—C4 | 124.4 (4) |
| C22—Gd1—C23 | 110.42 (16) | C8—C16—C25 | 119.5 (5) |
| O3—Gd1—Zn1 | 34.95 (7) | C8—C16—H16A | 120.3 |
| O5—Gd1—Zn1 | 59.49 (10) | C25—C16—H16A | 120.3 |
| O6—Gd1—Zn1 | 35.01 (7) | C14—C17—C2 | 119.1 (6) |
| O9—Gd1—Zn1 | 148.60 (9) | C14—C17—H17A | 120.5 |
| O2—Gd1—Zn1 | 123.47 (11) | C2—C17—H17A | 120.5 |
| O8—Gd1—Zn1 | 95.59 (10) | C3—C18—O4 | 125.9 (5) |
| O1—Gd1—Zn1 | 127.58 (10) | C3—C18—C10 | 121.7 (5) |
| O7—Gd1—Zn1 | 95.30 (7) | O4—C18—C10 | 112.5 (4) |
| O4—Gd1—Zn1 | 94.82 (8) | C1—C19—C14 | 119.5 (5) |
| C22—Gd1—Zn1 | 121.98 (13) | C1—C19—N1 | 124.2 (5) |
| C23—Gd1—Zn1 | 127.37 (11) | C14—C19—N1 | 116.2 (4) |
| O10—Zn1—O6 | 105.65 (14) | C27—C20—C12 | 117.8 (5) |
| O10—Zn1—O3 | 101.36 (14) | C27—C20—C21 | 124.3 (4) |
| O6—Zn1—O3 | 79.28 (13) | C12—C20—C21 | 117.8 (5) |
| O10—Zn1—N2 | 110.22 (15) | N1—C21—C20 | 125.6 (5) |
| O6—Zn1—N2 | 144.04 (15) | N1—C21—H21A | 117.2 |
| O3—Zn1—N2 | 91.09 (15) | C20—C21—H21A | 117.2 |
| O10—Zn1—N1 | 109.55 (15) | O8—C22—O9 | 120.1 (5) |
| O6—Zn1—N1 | 89.71 (14) | O8—C22—C28 | 120.2 (5) |
| O3—Zn1—N1 | 148.98 (15) | O9—C22—C28 | 119.7 (5) |
| N2—Zn1—N1 | 80.92 (16) | O8—C22—Gd1 | 60.3 (3) |
| O10—Zn1—Gd1 | 89.96 (10) | O9—C22—Gd1 | 59.9 (3) |
| O6—Zn1—Gd1 | 43.06 (9) | C28—C22—Gd1 | 177.1 (4) |
| O3—Zn1—Gd1 | 42.55 (9) | O2—C23—O1 | 120.5 (5) |
| N2—Zn1—Gd1 | 133.10 (12) | O2—C23—C6 | 118.3 (5) |
| N1—Zn1—Gd1 | 132.72 (12) | O1—C23—C6 | 121.1 (5) |
| C23—O1—Gd1 | 92.0 (3) | O2—C23—Gd1 | 59.9 (3) |
| C23—O2—Gd1 | 94.3 (3) | O1—C23—Gd1 | 61.7 (3) |
| C10—O3—Zn1 | 125.8 (3) | C6—C23—Gd1 | 167.8 (5) |
| C10—O3—Gd1 | 130.2 (3) | C26—C24—H24A | 109.5 |
| Zn1—O3—Gd1 | 102.50 (12) | C26—C24—H24B | 109.5 |
| C18—O4—C13 | 117.4 (4) | H24A—C24—H24B | 109.5 |
| C18—O4—Gd1 | 119.6 (3) | C26—C24—H24C | 109.5 |
| C13—O4—Gd1 | 122.9 (3) | H24A—C24—H24C | 109.5 |
| C26—O5—Gd1 | 146.3 (4) | H24B—C24—H24C | 109.5 |
| C27—O6—Zn1 | 126.2 (3) | C12—C25—C16 | 120.1 (5) |
| C27—O6—Gd1 | 129.1 (3) | C12—C25—H25A | 119.9 |
| Zn1—O6—Gd1 | 101.93 (12) | C16—C25—H25A | 119.9 |
| C8—O7—C5 | 118.1 (4) | O5—C26—O10 | 125.3 (5) |
| C8—O7—Gd1 | 119.5 (3) | O5—C26—C24 | 117.6 (5) |
| C5—O7—Gd1 | 122.1 (3) | O10—C26—C24 | 117.0 (5) |
| C22—O8—Gd1 | 93.3 (3) | O6—C27—C8 | 116.3 (4) |
| C22—O9—Gd1 | 93.5 (3) | O6—C27—C20 | 125.0 (4) |
| C26—O10—Zn1 | 118.7 (3) | C8—C27—C20 | 118.7 (4) |
| C21—N1—C19 | 123.6 (4) | C22—C28—H28A | 109.5 |
| C21—N1—Zn1 | 125.6 (4) | C22—C28—H28B | 109.5 |
| C19—N1—Zn1 | 110.7 (3) | H28A—C28—H28B | 109.5 |
| C4—N2—C14 | 124.1 (4) | C22—C28—H28C | 109.5 |
| C4—N2—Zn1 | 124.7 (3) | H28A—C28—H28C | 109.5 |
| C14—N2—Zn1 | 111.2 (3) | H28B—C28—H28C | 109.5 |