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Information card for entry 2002903
Preview
| Coordinates | 2002903.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H13 N O2 |
|---|---|
| Calculated formula | C7 H13 N O2 |
| SMILES | ONC(=O)C1CCCCC1 |
| Title of publication | Cyclohexanecarbohydroxamic Acid |
| Authors of publication | Larsen, Ingrid Kjoller; Trickey, Peter |
| Journal of publication | Acta Crystallographica, Section C: Crystal Structure Communications |
| Year of publication | 1995 |
| Journal volume | 51 |
| Journal issue | 1 |
| Pages of publication | 125 - 127 |
| a | 13.044 ± 0.003 Å |
| b | 6.847 ± 0.002 Å |
| c | 9.465 ± 0.004 Å |
| α | 90° |
| β | 98.46 ± 0.03° |
| γ | 90° |
| Cell volume | 836.1 ± 0.5 Å3 |
| Cell temperature | 294 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for significantly intense reflections | 0.0546 |
| Weighted residual factors for all reflections | 0.2005 |
| Weighted residual factors for significantly intense reflections | 0.1446 |
| Goodness-of-fit parameter for all reflections | 0.94 |
| Goodness-of-fit parameter for significantly intense reflections | 0.97 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.