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Information card for entry 7160368
Preview
| Coordinates | 7160368.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H20 N2 S |
|---|---|
| Calculated formula | C20 H20 N2 S |
| Title of publication | Cascade reaction of α-aryl vinyl and propargyl sulfonium salts with carbon nucleophiles: synthesis of functionalized benzyl and homoallyl thioethers. |
| Authors of publication | Awchar, Vilas M.; Baskaran, Sundarababu |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2025 |
| Journal volume | 23 |
| Journal issue | 11 |
| Pages of publication | 2610 - 2614 |
| a | 5.7116 ± 0.0003 Å |
| b | 9.0628 ± 0.0005 Å |
| c | 34.5624 ± 0.0019 Å |
| α | 90° |
| β | 92.604 ± 0.003° |
| γ | 90° |
| Cell volume | 1787.21 ± 0.17 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 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 all reflections | 0.0765 |
| Residual factor for significantly intense reflections | 0.0449 |
| Weighted residual factors for significantly intense reflections | 0.0931 |
| Weighted residual factors for all reflections included in the refinement | 0.1078 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299132 (current) | 2025-04-05 | cif/ Updating files of 7160368 Original log message: Adding full bibliography for 7160368.cif. |
7160368.cif |
| 297629 | 2025-02-07 | cif/ Adding structures of 7160368 via cif-deposit CGI script. |
7160368.cif |
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Users of the data should acknowledge the original authors of the
structural data.