Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7247417
Preview
| Coordinates | 7247417.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H18 Cu N8 O14 |
|---|---|
| Calculated formula | C8 H18 Cu N8 O14 |
| Title of publication | A new approach to study semi-coordination using two 2-methyl-5-nitroimidazole copper(ii) complexes of biological interest as a model system |
| Authors of publication | Fachini, Lucas G.; Baptistella, Gabriel B.; Postal, Kahoana; Santana, Francielli S.; de Souza, Emanuel M.; Ribeiro, Ronny R.; Nunes, Giovana G.; Sá, Eduardo L. |
| Journal of publication | RSC Advances |
| Year of publication | 2023 |
| Journal volume | 13 |
| Journal issue | 40 |
| Pages of publication | 27997 - 28007 |
| a | 6.714 ± 0.002 Å |
| b | 10.504 ± 0.004 Å |
| c | 14.095 ± 0.005 Å |
| α | 90° |
| β | 103.104 ± 0.011° |
| γ | 90° |
| Cell volume | 968.1 ± 0.6 Å3 |
| Cell temperature | 201 ± 2 K |
| Ambient diffraction temperature | 201 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0282 |
| Residual factor for significantly intense reflections | 0.0242 |
| Weighted residual factors for significantly intense reflections | 0.0668 |
| Weighted residual factors for all reflections included in the refinement | 0.0685 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286444 (current) | 2023-09-21 | cif/ Adding structures of 7247416, 7247417 via cif-deposit CGI script. |
7247417.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.