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Information card for entry 1574597
Preview
| Coordinates | 1574597.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H19 N3 S |
|---|---|
| Calculated formula | C18 H19 N3 S |
| Title of publication | Precise construction of spiro stereocenters via enantioselective radical addition through modulating photocatalysis from redox to energy transfer |
| Authors of publication | Liu, Fa-Yu; Guo, Yanqi; Lu, Weidong; Jiang, Zhiyong; Zhao, Xiaowei; Yin, Yanli |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 20.1236 ± 0.0005 Å |
| b | 7.0187 ± 0.0003 Å |
| c | 12.0117 ± 0.0004 Å |
| α | 90° |
| β | 97.82 ± 0.003° |
| γ | 90° |
| Cell volume | 1680.77 ± 0.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0465 |
| Residual factor for significantly intense reflections | 0.0419 |
| Weighted residual factors for significantly intense reflections | 0.1138 |
| Weighted residual factors for all reflections included in the refinement | 0.1186 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
| 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 |
|---|---|---|---|
| 299603 (current) | 2025-05-10 | cif/ Adding structures of 1574597 via cif-deposit CGI script. |
1574597.cif |
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Users of the data should acknowledge the original authors of the
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