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Information card for entry 7250581
Preview
| Coordinates | 7250581.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H18 Br2 Cl N O2 S |
|---|---|
| Calculated formula | C18 H18 Br2 Cl N O2 S |
| Title of publication | Selective synthesis of gem-dihalopiperidines and 4-halo-1,2,3,6-tetrahydropyridines from halogen substituted homoallylic benzenesulfonamides and aldehydes |
| Authors of publication | Bora, Surjya Kumar; Saikia, Anil K. |
| Journal of publication | RSC Advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 27 |
| Pages of publication | 21257 - 21268 |
| a | 11.4025 ± 0.0012 Å |
| b | 15.3012 ± 0.0015 Å |
| c | 11.8426 ± 0.0012 Å |
| α | 90° |
| β | 112.487 ± 0.004° |
| γ | 90° |
| Cell volume | 1909.1 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0406 |
| Residual factor for significantly intense reflections | 0.0299 |
| Weighted residual factors for significantly intense reflections | 0.0688 |
| Weighted residual factors for all reflections included in the refinement | 0.0726 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300170 (current) | 2025-06-24 | cif/ Adding structures of 7250580, 7250581, 7250582 via cif-deposit CGI script. |
7250581.cif |
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Users of the data should acknowledge the original authors of the
structural data.