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Information card for entry 2241094
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| Coordinates | 2241094.cif |
|---|---|
| Structure factors | 2241094.hkl |
| Original IUCr paper | HTML |
| Chemical name | Chloridotetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II) chloride |
|---|---|
| Formula | C12 H16 Cl2 Co N8 |
| Calculated formula | C12 H16 Cl2 Co N8 |
| SMILES | [Co](Cl)([n]1c[nH]cc1)([n]1c[nH]cc1)([n]1c[nH]cc1)[n]1c[nH]cc1.[Cl-] |
| Title of publication | Etude structurale et vibrationnelle d'un nouveau composé complexe de cobalt: [Co(imidazole)~4~Cl]Cl |
| Authors of publication | Derbel, Amira; Mhiri, Tahar; Graia, Mohsen |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 10 |
| Pages of publication | 1185 - 1189 |
| a | 8.8665 ± 0.0003 Å |
| b | 13.3043 ± 0.0006 Å |
| c | 13.9154 ± 0.0005 Å |
| α | 90° |
| β | 89.998 ± 0.002° |
| γ | 90° |
| Cell volume | 1641.5 ± 0.11 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0305 |
| Residual factor for significantly intense reflections | 0.0272 |
| Weighted residual factors for significantly intense reflections | 0.0705 |
| Weighted residual factors for all reflections included in the refinement | 0.0719 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.09 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181911 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/10. |
2241094.cif 2241094.hkl |
| 158348 | 2015-09-26 | cif/ hkl/ Adding structures of 2241094 via cif-deposit CGI script. |
2241094.cif 2241094.hkl |
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public domain and licensed under the
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.
Users of the data should acknowledge the original authors of the
structural data.