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Information card for entry 1556938
Preview
| Coordinates | 1556938.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H26 B F5 N O P S |
|---|---|
| Calculated formula | C21 H26 B F5 N O P S |
| Title of publication | Design, synthesis and application of a new type of bifunctional Le-Phos in highly enantioselective γ-addition reactions of N-centered nucleophiles to allenoates |
| Authors of publication | Qiu, Haile; Chen, Xiaofeng; Zhang, Junliang |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| Journal volume | 10 |
| Journal issue | 45 |
| Pages of publication | 10510 |
| a | 17.1138 ± 0.0014 Å |
| b | 6.6266 ± 0.0005 Å |
| c | 20.6037 ± 0.0016 Å |
| α | 90° |
| β | 93.452 ± 0.003° |
| γ | 90° |
| Cell volume | 2332.4 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0965 |
| Residual factor for significantly intense reflections | 0.0714 |
| Weighted residual factors for significantly intense reflections | 0.1665 |
| Weighted residual factors for all reflections included in the refinement | 0.18 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 246602 (current) | 2020-01-05 | cif/ Adding structures of 1556936, 1556937, 1556938, 1556939 via cif-deposit CGI script. |
1556938.cif |
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Users of the data should acknowledge the original authors of the
structural data.