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Information card for entry 2214525
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| Coordinates | 2214525.cif |
|---|---|
| Structure factors | 2214525.hkl |
| Original IUCr paper | HTML |
| Common name | pyrazolocarbazole |
|---|---|
| Chemical name | 1,10-Dihydro-3,9-dimethylpyrazolo[3,4-a]carbazole |
| Formula | C15 H13 N3 |
| Calculated formula | C15 H13 N3 |
| Title of publication | 1,10-Dihydro-3,9-dimethylpyrazolo[3,4-<i>a</i>]carbazole |
| Authors of publication | A. Ebenezer Martin; A. Thomas Gunaseelan; A. Thiruvalluvar; K. J. Rajendra Prasad; R. J. Butcher |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2007 |
| Journal volume | 63 |
| Journal issue | 8 |
| Pages of publication | o3471 - o3471 |
| a | 11.6553 ± 0.0008 Å |
| b | 5.7418 ± 0.0003 Å |
| c | 18.0804 ± 0.0012 Å |
| α | 90° |
| β | 101.796 ± 0.006° |
| γ | 90° |
| Cell volume | 1184.43 ± 0.13 Å3 |
| Cell temperature | 203 ± 2 K |
| Ambient diffraction temperature | 203 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1142 |
| Residual factor for significantly intense reflections | 0.0432 |
| Weighted residual factors for significantly intense reflections | 0.0841 |
| Weighted residual factors for all reflections included in the refinement | 0.0956 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.812 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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