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Information card for entry 2006993
Preview
| Coordinates | 2006993.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | 1,3,3,2'-Tetramethylspiro[indoline-2,3'-[3H]phenanthro[9,10-b][1,4]oxazine] |
|---|---|
| Formula | C27 H24 N2 O |
| Calculated formula | C27 H24 N2 O |
| SMILES | O1C2(N(c3ccccc3C2(C)C)C)C(=Nc2c3ccccc3c3ccccc3c12)C |
| Title of publication | 1,3,3-Trimethylindoline-2-spiro-2'-3'-methyl-2'<i>H</i>-phenanthro[9,10-<i>b</i>][1,4]oxazine |
| Authors of publication | Liang, Yong-Chao; Chen, Xue-An; Zhao, Ling; Zhang, Qi-Yuan; Chen, Jian-Xin; Ming, Yang-Fu; Fan, Mei-Gong |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 2 |
| Pages of publication | 279 - 281 |
| a | 9.766 ± 0.002 Å |
| b | 16.184 ± 0.003 Å |
| c | 13.456 ± 0.002 Å |
| α | 90° |
| β | 100.82 ± 0.02° |
| γ | 90° |
| Cell volume | 2089 ± 0.7 Å3 |
| Cell temperature | 293 K |
| Number of distinct elements | 4 |
| 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 | 0.0398 |
| Weighted residual factors for all reflections | 0.1086 |
| Weighted residual factors for significantly intense reflections | 0.1011 |
| Goodness-of-fit parameter for all reflections | 0.946 |
| Goodness-of-fit parameter for significantly intense reflections | 1.098 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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