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Information card for entry 2010181
Preview
| Coordinates | 2010181.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C11 H11 N O2 S |
|---|---|
| Calculated formula | C11 H11 N O2 S |
| Title of publication | 2-Acetyl-3-methyl-4<i>H</i>-1,4-benzothiazine 1-oxide |
| Authors of publication | Chen, W.; Teo, S.-B.; Teoh, S.-G.; Okechuwu, R.C. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1994 |
| Journal volume | 50 |
| Journal issue | 11 |
| Pages of publication | 1756 - 1758 |
| a | 7.763 ± 0.001 Å |
| b | 7.751 ± 0.001 Å |
| c | 17.071 ± 0.004 Å |
| α | 90° |
| β | 96.26 ± 0.02° |
| γ | 90° |
| Cell volume | 1021.1 ± 0.3 Å3 |
| Cell temperature | 300 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for significantly intense reflections | 0.047 |
| Goodness-of-fit parameter for significantly intense reflections | 0.75 |
| 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.