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Information card for entry 7058089
Preview
| Coordinates | 7058089.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H25 Cu F N6 O3 |
|---|---|
| Calculated formula | C36 H25 Cu F N6 O3 |
| Title of publication | Copper(ii) complexes with 4-acyl pyrazolone derivatives and diimine coligands: synthesis, structural characterization, DNA binding and antitumor activity |
| Authors of publication | Wang, Jun; Xu, Guan-Cheng; Zhang, Yan-Ping; Luo, Hua-Ying; Li, Jin-Yao; Zhang, Li; Jia, Dian-Zeng |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2019 |
| Journal volume | 43 |
| Journal issue | 6 |
| Pages of publication | 2529 |
| a | 5.7668 ± 0.0008 Å |
| b | 21.831 ± 0.003 Å |
| c | 11.7987 ± 0.0016 Å |
| α | 90° |
| β | 97.694 ± 0.002° |
| γ | 90° |
| Cell volume | 1472 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0468 |
| Residual factor for significantly intense reflections | 0.0387 |
| Weighted residual factors for significantly intense reflections | 0.0756 |
| Weighted residual factors for all reflections included in the refinement | 0.0783 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301851 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 7/05/ Each referenced PubChem compound corresponds to the full crystal structure. |
7058089.cif |
| 224828 | 2019-11-08 | cif/ Updating files of 7058088, 7058089, 7058090, 7058091 Original log message: Adding full bibliography for 7058088--7058091.cif. |
7058089.cif |
| 212982 | 2019-01-11 | cif/ Adding structures of 7058088, 7058089, 7058090, 7058091 via cif-deposit CGI script. |
7058089.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.