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Information card for entry 2241038
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| Coordinates | 2241038.cif |
|---|---|
| Structure factors | 2241038.hkl |
| Original IUCr paper | HTML |
| Chemical name | Bis(2-methyl-1<i>H</i>-imidazol-3-ium) tetrachloridocobaltate(II) |
|---|---|
| Formula | C8 H14 Cl4 Co N4 |
| Calculated formula | C8 H14 Cl4 Co N4 |
| SMILES | [nH]1c([nH+]cc1)C.[nH]1c([nH+]cc1)C.[Co](Cl)(Cl)([Cl-])[Cl-] |
| Title of publication | Crystal structure of bis(2-methyl-1<i>H</i>-imidazol-3-ium) tetrachloridocobaltate(II) |
| Authors of publication | Diop, Mouhamadou Birame; Diop, Libasse; Maris, Thierry |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 9 |
| Pages of publication | 1064 - 1066 |
| a | 26.847 ± 0.003 Å |
| b | 7.9029 ± 0.0008 Å |
| c | 15.0938 ± 0.0014 Å |
| α | 90° |
| β | 111.184 ± 0.006° |
| γ | 90° |
| Cell volume | 2986 ± 0.5 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 all reflections | 0.051 |
| Residual factor for significantly intense reflections | 0.0422 |
| Weighted residual factors for significantly intense reflections | 0.0954 |
| Weighted residual factors for all reflections included in the refinement | 0.1016 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| 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. |
2241038.cif 2241038.hkl |
| 153598 | 2015-08-22 | cif/ hkl/ Adding structures of 2241038 via cif-deposit CGI script. |
2241038.cif 2241038.hkl |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.