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Information card for entry 7160732
Preview
| Coordinates | 7160732.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H24 N2 O2 S |
|---|---|
| Calculated formula | C15 H24 N2 O2 S |
| Title of publication | Synthesis of N-Sulfonyl Acetamidines Using Calcium Carbide as an Alkyne Source |
| Authors of publication | Chen, Wei; Wang, Zhiqiang; Yang, Jinhui; Li, Zheng |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 7.8198 ± 0.0002 Å |
| b | 25.8453 ± 0.0004 Å |
| c | 8.2657 ± 0.0001 Å |
| α | 90° |
| β | 101.258 ± 0.002° |
| γ | 90° |
| Cell volume | 1638.4 ± 0.05 Å3 |
| Cell temperature | 149.98 ± 0.1 K |
| Ambient diffraction temperature | 149.98 ± 0.1 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 | 0.0528 |
| Residual factor for significantly intense reflections | 0.0513 |
| Weighted residual factors for significantly intense reflections | 0.1429 |
| Weighted residual factors for all reflections included in the refinement | 0.1444 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302192 (current) | 2025-09-19 | cif/ Adding structures of 7160732 via cif-deposit CGI script. |
7160732.cif |
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Users of the data should acknowledge the original authors of the
structural data.