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Information card for entry 2241930
Preview
| Coordinates | 2241930.cif |
|---|---|
| Structure factors | 2241930.hkl |
| Original IUCr paper | HTML |
| Chemical name | 12-(4-Nitrophenyl)-7-phenylsulfonyl-7<i>H</i>-benzofuro[2,3-<i>b</i>]carbazole |
|---|---|
| Formula | C30 H18 N2 O5 S |
| Calculated formula | C30 H18 N2 O5 S |
| Title of publication | Crystal structures of two new carbazole derivatives: 12-(4-nitrophenyl)-7-phenylsulfonyl-7<i>H</i>-benzofuro[2,3-<i>b</i>]carbazole and 2-methyl-4-(4-nitrophenyl)-9-phenylsulfonyl-9<i>H</i>-thieno[2,3-<i>b</i>]carbazole |
| Authors of publication | Swaminathan, K.; Narayanan, P.; Sethusankar, K.; Saravanan, Velu; Mohanakrishnan, Arasambattu K. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2016 |
| Journal volume | 72 |
| Journal issue | 12 |
| Pages of publication | 1739 - 1743 |
| a | 12.1347 ± 0.0005 Å |
| b | 12.0708 ± 0.0005 Å |
| c | 17.6391 ± 0.0007 Å |
| α | 90° |
| β | 108.617 ± 0.002° |
| γ | 90° |
| Cell volume | 2448.5 ± 0.18 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 all reflections | 0.0779 |
| Residual factor for significantly intense reflections | 0.0425 |
| Weighted residual factors for significantly intense reflections | 0.1066 |
| Weighted residual factors for all reflections included in the refinement | 0.1312 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 187837 (current) | 2016-11-05 | cif/ hkl/ Adding structures of 2241930, 2241931 via cif-deposit CGI script. |
2241930.cif 2241930.hkl |
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Users of the data should acknowledge the original authors of the
structural data.