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CIF Information Card
Information card for 2015310
2015309 << 2015310 >> 2015311Preview
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Coordinates |
2015310.cif |
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Original IUCr paper |
HTML |
Structure parameters
| Chemical name | 2-methyl-4-nitroanilinium iodide |
| Formula | - C7 H9 I N2 O2 - |
| Calculated formula | - C7 H9 I N2 O2 - |
| Title of publication | Hydrogen bonding in isomorphous 2-methyl-4-nitroanilinium bromide and iodide |
| Authors of publication | Lemmerer, Andreas; Billing, David G. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 5 |
| Pages of publication | o271 - o273 |
| a | 14.671 ± 0.004 Å |
| b | 9.83 ± 0.003 Å |
| c | 6.875 ± 0.002 Å |
| α | 90° |
| β | 93.782 ± 0.007° |
| γ | 90° |
| Cell volume | 989.4 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for observed reflections | 0.0701 |
| Weighted residual factors for all reflections included in the refinement | 0.1865 |
| Goodness-of-fit parameter for observed reflections | 0.941 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |