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Information card for entry 7160672
Preview
| Coordinates | 7160672.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C11.2 H9.6 O2.8 S0.8 |
|---|---|
| Calculated formula | C11.2 H9.6 O2.8 S0.8 |
| Title of publication | One-pot Synthesis of Sulfonyl Benzotropones |
| Authors of publication | Chang, Meng-Yang; Ho, Chin-Huey |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 8.273 ± 0.0002 Å |
| b | 11.156 ± 0.0002 Å |
| c | 14.9832 ± 0.0003 Å |
| α | 73.191 ± 0.002° |
| β | 78.841 ± 0.002° |
| γ | 72.236 ± 0.002° |
| Cell volume | 1252.22 ± 0.05 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0391 |
| Residual factor for significantly intense reflections | 0.0346 |
| Weighted residual factors for significantly intense reflections | 0.092 |
| Weighted residual factors for all reflections included in the refinement | 0.095 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301712 (current) | 2025-08-12 | cif/ Adding structures of 7160667, 7160668, 7160669, 7160670, 7160671, 7160672, 7160673, 7160674 via cif-deposit CGI script. |
7160672.cif |
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Users of the data should acknowledge the original authors of the
structural data.