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Information card for entry 1566847
Preview
| Coordinates | 1566847.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H21 N O2 |
|---|---|
| Calculated formula | C15 H21 N O2 |
| Title of publication | Selective Radical Cascade (4+2) Annulation with Olefins towards the Synthesis of Chroman Derivatives via Organo-Photoredox Catalysis |
| Authors of publication | Guan, Zhipeng; Zhong, Xingxing; Ye, Yayu; Li, Xiangwei; Cong, Hengjiang; Yi, Hong; Zhang, Heng; Huang, Zhiliang; Lei, Aiwen |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 9.7766 ± 0.0001 Å |
| b | 13.914 ± 0.0002 Å |
| c | 21.1903 ± 0.0003 Å |
| α | 90° |
| β | 97.758 ± 0.001° |
| γ | 90° |
| Cell volume | 2856.17 ± 0.06 Å3 |
| Cell temperature | 274 ± 2 K |
| Ambient diffraction temperature | 274 ± 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 | 0.0627 |
| Residual factor for significantly intense reflections | 0.049 |
| Weighted residual factors for significantly intense reflections | 0.1344 |
| Weighted residual factors for all reflections included in the refinement | 0.1451 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| 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 |
|---|---|---|---|
| 274627 (current) | 2022-04-22 | cif/ Adding structures of 1566847 via cif-deposit CGI script. |
1566847.cif |
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Users of the data should acknowledge the original authors of the
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