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Information card for entry 7160589
Preview
| Coordinates | 7160589.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H18 N2 O3 |
|---|---|
| Calculated formula | C16 H18 N2 O3 |
| Title of publication | Harnessing the reactivity of captodative radicals: photocatalytic α-pyridination of glycyl derivatives through reversible radical coupling |
| Authors of publication | Yamazaki, Ken; Akimoto, Shuta; Miura, Tomoya |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 8.1083 ± 0.0005 Å |
| b | 9.6805 ± 0.0005 Å |
| c | 10.8014 ± 0.0005 Å |
| α | 84.851 ± 0.004° |
| β | 69.482 ± 0.005° |
| γ | 67.945 ± 0.005° |
| Cell volume | 735.08 ± 0.08 Å3 |
| Cell temperature | 173.15 K |
| Ambient diffraction temperature | 173.15 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 | 0.0455 |
| Residual factor for significantly intense reflections | 0.0382 |
| Weighted residual factors for significantly intense reflections | 0.0986 |
| Weighted residual factors for all reflections included in the refinement | 0.1028 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.065 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300046 (current) | 2025-06-11 | cif/ Adding structures of 7160589, 7160590 via cif-deposit CGI script. |
7160589.cif |
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Users of the data should acknowledge the original authors of the
structural data.