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Information card for entry 1566061
Preview
| Coordinates | 1566061.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H16 Cu N6 O6 |
|---|---|
| Calculated formula | C18 H16 Cu N6 O6 |
| Title of publication | Two Cu(II) and Zn(II) complexes derived from 5-(Pyrazol-1-yl)nicotinic acid: Crystal structure, DNA binding and anticancer studies |
| Authors of publication | Ji, Xiaoxi; Zhu, Xiaopeng; Chen, Shiyu; Song, Dongxue; Wu, Shuangyan; Zhang, Ying; Gao, Enjun; Xu, Jin; Zhu, Mingchang |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2022 |
| Journal volume | 305 |
| Pages of publication | 122707 |
| a | 6.7918 ± 0.0006 Å |
| b | 10.8202 ± 0.0008 Å |
| c | 13.232 ± 0.001 Å |
| α | 90° |
| β | 104.493 ± 0.003° |
| γ | 90° |
| Cell volume | 941.46 ± 0.13 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 149.96 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0548 |
| Residual factor for significantly intense reflections | 0.0433 |
| Weighted residual factors for significantly intense reflections | 0.1278 |
| Weighted residual factors for all reflections included in the refinement | 0.138 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 272155 (current) | 2022-01-20 | cif/ Adding structures of 1566061, 1566062 via cif-deposit CGI script. |
1566061.cif |
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