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Information card for entry 7063893
Preview
| Coordinates | 7063893.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H12 Cl2 Cu N2 O |
|---|---|
| Calculated formula | C12 H12 Cl2 Cu N2 O |
| Title of publication | A mono nuclear Cu(II) complex as a functional mimic of both catechol oxidase and phenoxazinone synthase enzyme |
| Authors of publication | Kumar, Bidyapati; Chatterjee, Abhishikta; Chakraborty, Priyanka; Mondal, Sourav; Dey, Subrata K. |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 29.4663 ± 0.0017 Å |
| b | 10.4668 ± 0.0005 Å |
| c | 8.6344 ± 0.0005 Å |
| α | 90° |
| β | 95.322 ± 0.003° |
| γ | 90° |
| Cell volume | 2651.5 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0612 |
| Residual factor for significantly intense reflections | 0.0436 |
| Weighted residual factors for significantly intense reflections | 0.1203 |
| Weighted residual factors for all reflections included in the refinement | 0.1435 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.139 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301256 (current) | 2025-07-15 | cif/ Adding structures of 7063893 via cif-deposit CGI script. |
7063893.cif |
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