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Information card for entry 1574871
Preview
| Coordinates | 1574871.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H43.75 B F6 N2 Ni P2 |
|---|---|
| Calculated formula | C46 H43.75 B F6 N2 Ni P2 |
| Title of publication | Nickel-Catalyzed Diastereoselective Hydroboration of Acrylates with a Vinylborane Reagent |
| Authors of publication | Zhang, Peiqi; Wan, Chunteng; Fu, Yiyi; Quan, Yangjian; Hu, Guanwen; Wang, Xinmou; Leung, Wa-Hung; Lin, Zhenyang |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 12.01864 ± 0.00011 Å |
| b | 11.91416 ± 0.00009 Å |
| c | 28.869 ± 0.0002 Å |
| α | 90° |
| β | 92.2828 ± 0.0008° |
| γ | 90° |
| Cell volume | 4130.53 ± 0.06 Å3 |
| Cell temperature | 99.98 ± 0.1 K |
| Ambient diffraction temperature | 99.98 ± 0.1 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0411 |
| Residual factor for significantly intense reflections | 0.0349 |
| Weighted residual factors for significantly intense reflections | 0.0903 |
| Weighted residual factors for all reflections included in the refinement | 0.0947 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300072 (current) | 2025-06-14 | cif/ Adding structures of 1574870, 1574871, 1574872 via cif-deposit CGI script. |
1574871.cif |
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