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CIF Information Card
Information card for 4107183
4107182 << 4107183 >> 4107184Preview
|
Coordinates |
4107183.cif |
Structure parameters
| Formula | - C4 H12 B N - |
| Calculated formula | - C4 H12 B N - |
| Title of publication | A Single-Component Liquid-Phase Hydrogen Storage Material |
| Authors of publication | Wei Luo; Patrick G. Campbell; Lev N. Zakharov; Shih-Yuan Liu |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2011 |
| Journal volume | 133 |
| Pages of publication | 19326 - 19329 |
| a | 9.919 ± 0.003 Å |
| b | 7.278 ± 0.002 Å |
| c | 9.294 ± 0.003 Å |
| α | 90° |
| β | 117.149 ± 0.005° |
| γ | 90° |
| Cell volume | 597 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.0884 |
| Residual factor for observed reflections | 0.071 |
| Weighted residual factors for the observed reflections | 0.1978 |
| Weighted residual factors for all reflections included in the refinement | 0.2147 |
| Goodness-of-fit parameter for observed reflections | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |