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Information card for entry 2105259
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| Coordinates | Coordinates are not available: file is not found. |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | 5,6-benzfurazan 1-oxide - polymorph Z10 |
|---|---|
| Formula | C8 H8 N2 O2 |
| Calculated formula | C8 H8 N2 O2 |
| Title of publication | Four polymorphs (polytypes) of 5,6-dimethylbenzofurazan 1-oxide |
| Authors of publication | Britton, Doyle; Young, Jr, Victor G.; Noland, Wayland E.; Pinnow, Matthew J.; Clark, Christopher M. |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 5 |
| Pages of publication | 536 - 542 |
| a | 9.0136 ± 0.0018 Å |
| b | 13.064 ± 0.003 Å |
| c | 16.567 ± 0.003 Å |
| α | 95.055 ± 0.004° |
| β | 97.969 ± 0.004° |
| γ | 90.742 ± 0.004° |
| Cell volume | 1923.8 ± 0.7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1925 |
| Residual factor for significantly intense reflections | 0.1143 |
| Weighted residual factors for significantly intense reflections | 0.2661 |
| Weighted residual factors for all reflections included in the refinement | 0.3381 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.969 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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