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Information card for entry 7160141
Preview
| Coordinates | 7160141.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H24 Br N O2 S |
|---|---|
| Calculated formula | C31 H24 Br N O2 S |
| Title of publication | Enantioselective organocatalyzed one-pot synthesis of <i>N</i>-phenyl thioether-tethered tetrasubstituted dihydropyrrole-3-carbaldehydes. |
| Authors of publication | Pandidurai, Solai; Sekar, Govindasamy |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2024 |
| Journal volume | 22 |
| Journal issue | 40 |
| Pages of publication | 8119 - 8124 |
| a | 8.2477 ± 0.0002 Å |
| b | 10.7805 ± 0.0003 Å |
| c | 15.3993 ± 0.0004 Å |
| α | 80.6827 ± 0.0013° |
| β | 78.5517 ± 0.0012° |
| γ | 76.5102 ± 0.0012° |
| Cell volume | 1295.32 ± 0.06 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0412 |
| Residual factor for significantly intense reflections | 0.0291 |
| Weighted residual factors for significantly intense reflections | 0.0671 |
| Weighted residual factors for all reflections included in the refinement | 0.071 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296696 (current) | 2024-12-06 | cif/ Updating files of 7160141, 7160142 Original log message: Adding full bibliography for 7160141--7160142.cif. |
7160141.cif |
| 294727 | 2024-09-12 | cif/ Adding structures of 7160141, 7160142 via cif-deposit CGI script. |
7160141.cif |
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Users of the data should acknowledge the original authors of the
structural data.