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Information card for entry 4518675
Preview
| Coordinates | 4518675.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H29 N O |
|---|---|
| Calculated formula | C26 H29 N O |
| Title of publication | Ligand-Controlled Ni(0)‒Al(III) Bimetal-Catalyzed C3‒H Alkenylation of 2-Pyridones by Reversing Conventional Selectivity |
| Authors of publication | Yin, Ge; Li, Yue; Wang, Rong-Hua; Li, Jiang-Fei; Xu, Xue-Tao; Luan, Yu-Xin; Ye, Mengchun |
| Journal of publication | ACS Catalysis |
| Year of publication | 2021 |
| Journal volume | 11 |
| Journal issue | 8 |
| Pages of publication | 4606 - 4612 |
| a | 13.737 ± 0.003 Å |
| b | 14.478 ± 0.003 Å |
| c | 22.319 ± 0.005 Å |
| α | 79.86 ± 0.03° |
| β | 77.01 ± 0.03° |
| γ | 76.01 ± 0.03° |
| Cell volume | 4162.1 ± 1.7 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113 ± 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 | 0.0999 |
| Residual factor for significantly intense reflections | 0.0717 |
| Weighted residual factors for significantly intense reflections | 0.1892 |
| Weighted residual factors for all reflections included in the refinement | 0.2149 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.097 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 264792 (current) | 2021-05-03 | cif/ Adding structures of 4518675 via cif-deposit CGI script. |
4518675.cif |
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