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Information card for entry 1568241
Preview
| Coordinates | 1568241.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H8 Br2 Cu N8 O2 Se2 |
|---|---|
| Calculated formula | C10 H8 Br2 Cu N8 O2 Se2 |
| Title of publication | Chalcogen bonding in copper(II)-mediated synthesis. |
| Authors of publication | Aliyeva, Vusala A.; Gurbanov, Atash V.; Mahmoud, Abdallah G.; Gomila, Rosa M.; Frontera, Antonio; Mahmudov, Kamran T.; Pombeiro, Armando J. L. |
| Journal of publication | Faraday discussions |
| Year of publication | 2023 |
| Journal volume | 244 |
| Journal issue | 0 |
| Pages of publication | 77 - 95 |
| a | 5.4742 ± 0.0015 Å |
| b | 7.767 ± 0.002 Å |
| c | 11.921 ± 0.004 Å |
| α | 73.52 ± 0.008° |
| β | 79.658 ± 0.008° |
| γ | 70.146 ± 0.007° |
| Cell volume | 455.2 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0904 |
| Residual factor for significantly intense reflections | 0.0506 |
| Weighted residual factors for significantly intense reflections | 0.0894 |
| Weighted residual factors for all reflections included in the refinement | 0.1013 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 286135 (current) | 2023-09-05 | cif/ Updating files of 1568240, 1568241, 1568242, 1568243 Original log message: Adding full bibliography for 1568240--1568243.cif. |
1568241.cif |
| 280240 | 2023-01-07 | cif/ Adding structures of 1568241 via cif-deposit CGI script. |
1568241.cif |
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Users of the data should acknowledge the original authors of the
structural data.