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Information card for entry 2206636
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| Coordinates | 2206636.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | [C~12~mim]Br.H~2~O |
|---|---|
| Chemical name | 1-Dodecyl-3-methylimidazolium bromide monohydrate |
| Formula | C16 H33 Br N2 O |
| Calculated formula | C16 H33 Br N2 O |
| Title of publication | 1-Dodecyl-3-methylimidazolium bromide monohydrate |
| Authors of publication | Getsis, Anna; Mudring, Anja-Verena |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 9 |
| Pages of publication | o2945 - o2946 |
| a | 5.5 ± 0.005 Å |
| b | 7.794 ± 0.005 Å |
| c | 22.961 ± 0.005 Å |
| α | 81.893 ± 0.005° |
| β | 83.761 ± 0.005° |
| γ | 78.102 ± 0.005° |
| Cell volume | 950.3 ± 1.1 Å3 |
| Cell temperature | 263 ± 2 K |
| Ambient diffraction temperature | 263 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.035 |
| Residual factor for significantly intense reflections | 0.0263 |
| Weighted residual factors for significantly intense reflections | 0.0652 |
| Weighted residual factors for all reflections included in the refinement | 0.0694 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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