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Information card for entry 1557463
Preview
| Coordinates | 1557463.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [C6H5(CH3)3N]2[SeBr6] |
|---|---|
| Formula | C18 H28 Br6 N2 Se |
| Calculated formula | C18 Br6 N2 |
| SMILES | [N+](C)(C)(C)c1ccccc1.[Br-].[Br-].[Br-] |
| Title of publication | Syntheses and Crystal Structures of Phenyltrimethylammonium Salts of Hexabromoselenate(IV), [C6H5(CH3)3N]2[SeBr6], and catena-poly[(Di-mu-bromobis{tetrabromotellurate(IV)})-mu-bromine], [C6H5(CH3)3N]2n[Se2Br10.Br2]n |
| Authors of publication | Hauge, Sverre; Maroy, Kjartan |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1996 |
| Journal volume | 50 |
| Pages of publication | 399 - 404 |
| a | 8.681 ± 0.002 Å |
| b | 10.533 ± 0.003 Å |
| c | 14.06 ± 0.002 Å |
| α | 90° |
| β | 104.26 ± 0.02° |
| γ | 90° |
| Cell volume | 1246 ± 0.5 Å3 |
| Ambient diffraction temperature | 93 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 significantly intense reflections | 0.03 |
| Weighted residual factors for significantly intense reflections | 0.028 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 248762 (current) | 2020-03-04 | cif/ Adding structures of 1557463 via cif-deposit CGI script. |
1557463.cif |
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Users of the data should acknowledge the original authors of the
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