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Information card for entry 7158974
Preview
| Coordinates | 7158974.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C17 H17 I N2 O2 S |
|---|---|
| Calculated formula | C17 H17 I N2 O2 S |
| Title of publication | Pd-catalysed intramolecular transformations of indolylbenzenesulfonamides: ortho-sulfonamido-bi(hetero)aryls via C2-arylation and polycyclic sultams via C3 arylation |
| Authors of publication | Sunke, Rajnikanth; Ahmed Khan, Shabbir; Kumara Swamy, K. C. |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2022 |
| a | 6.2737 ± 0.0004 Å |
| b | 18.0774 ± 0.0006 Å |
| c | 16.6031 ± 0.0008 Å |
| α | 90° |
| β | 112.875 ± 0.008° |
| γ | 90° |
| Cell volume | 1734.91 ± 0.18 Å3 |
| Cell temperature | 297.54 ± 0.1 K |
| Ambient diffraction temperature | 297.54 ± 0.1 K |
| Number of distinct elements | 6 |
| 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 | 0.0458 |
| Residual factor for significantly intense reflections | 0.0405 |
| Weighted residual factors for significantly intense reflections | 0.1171 |
| Weighted residual factors for all reflections included in the refinement | 0.1204 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 279132 (current) | 2022-11-09 | cif/ Adding structures of 7158974, 7158975, 7158976, 7158977, 7158978, 7158979 via cif-deposit CGI script. |
7158974.cif |
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Users of the data should acknowledge the original authors of the
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