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Information card for entry 1543418
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| Coordinates | 1543418.cif |
|---|---|
| Structure factors | 1543418.hkl |
| Original IUCr paper | HTML |
| Chemical name | 3,5-Dibromo-4-methylpyridine |
|---|---|
| Formula | C6 H5 Br2 N |
| Calculated formula | C6 H5 Br2 N |
| Title of publication | 3,5-Dibromo-4-methylpyridine |
| Authors of publication | Medjani, Meriem; Brihi, Ouarda; Bouraoui, Hazem; Hamdouni, Noudjoud; Boudjada, Ali; Meinnel, Jean |
| Journal of publication | IUCrData |
| Year of publication | 2016 |
| Journal volume | 1 |
| Journal issue | 6 |
| Pages of publication | x160859 |
| a | 14.178 ± 0.003 Å |
| b | 6.9187 ± 0.0018 Å |
| c | 7.6407 ± 0.0012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 749.5 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor for all reflections | 0.122 |
| Residual factor for significantly intense reflections | 0.0511 |
| Weighted residual factors for significantly intense reflections | 0.125 |
| Weighted residual factors for all reflections included in the refinement | 0.125 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 183357 (current) | 2016-06-11 | cif/ hkl/ Adding structures of 1543418 via cif-deposit CGI script. |
1543418.cif 1543418.hkl |
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