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Information card for entry 7160507
Preview
| Coordinates | 7160507.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H27 N O3 |
|---|---|
| Calculated formula | C28 H27 N O3 |
| Title of publication | Electrochemical regioselective reduction of α-keto amide with methanol as hydrogen source |
| Authors of publication | Zhang, Jin Jin; wang, jinghong; Sang, Ya Hui; Qin, Haijuan; Chen, Chao; Liu, Wei |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 9.36186 ± 0.00016 Å |
| b | 16.38187 ± 0.0002 Å |
| c | 15.377 ± 0.0003 Å |
| α | 90° |
| β | 102.909 ± 0.0017° |
| γ | 90° |
| Cell volume | 2298.69 ± 0.07 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0445 |
| Residual factor for significantly intense reflections | 0.0426 |
| Weighted residual factors for significantly intense reflections | 0.1046 |
| Weighted residual factors for all reflections included in the refinement | 0.1059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
| 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 |
|---|---|---|---|
| 299334 (current) | 2025-04-19 | cif/ Adding structures of 7160507 via cif-deposit CGI script. |
7160507.cif |
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Users of the data should acknowledge the original authors of the
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