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Information card for entry 8101534
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| Coordinates | 8101534.cif |
|---|
| Formula | C18 H28 Br4 Co N2 |
|---|---|
| Calculated formula | C18 H28 Br4 Co N2 |
| SMILES | [Co](Br)(Br)([Br-])[Br-].[N+](c1ccccc1)(C)(C)C.[N+](c1ccccc1)(C)(C)C |
| Title of publication | Crystal structure of bis(trimethylphenylammonium) tetrabromocobaltate, [Me~3~PhN]~2~[CoBr~4~], and of bis(trimethylphenylammonium) tetrachlorocobaltate, [Me~3~PhN]~2~[CoCl~4~] |
| Authors of publication | Wiest, Thomas; Eickmeier, Henning; Reuter, Hans; Blachnik, Roger |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 1999 |
| Journal volume | 214 |
| Journal issue | 3 |
| Pages of publication | 394 - 396 |
| a | 15.994 ± 0.003 Å |
| b | 9.78 ± 0.002 Å |
| c | 31.354 ± 0.004 Å |
| α | 90° |
| β | 94.46 ± 0.01° |
| γ | 90° |
| Cell volume | 4889.6 ± 1.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for significantly intense reflections | 0.0542 |
| Weighted residual factors for significantly intense reflections | 0.1039 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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