Information card for entry 7127987
| Formula |
C10 H13 P S |
| Calculated formula |
C10 H13 P S |
| SMILES |
S=[P@@](C1CC1)(C)c1ccccc1 |
| Title of publication |
A facile and practical preparation of P-chiral phosphine oxides. |
| Authors of publication |
Xu, Ronghua; Gao, Zhenhua; Yu, Yiteng; Tang, Yehua; Tian, Duanshuai; Chen, Tian; Chen, Yibing; Xu, Guangqing; Shi, Enxue; Tang, Wenjun |
| Journal of publication |
Chemical communications (Cambridge, England) |
| Year of publication |
2021 |
| Journal volume |
57 |
| Journal issue |
27 |
| Pages of publication |
3335 - 3338 |
| a |
9.1461 ± 0.0003 Å |
| b |
9.681 ± 0.0003 Å |
| c |
11.8702 ± 0.0003 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
1051.03 ± 0.05 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
19 |
| Hermann-Mauguin space group symbol |
P 21 21 21 |
| Hall space group symbol |
P 2ac 2ab |
| Residual factor for all reflections |
0.0247 |
| Residual factor for significantly intense reflections |
0.0238 |
| Weighted residual factors for significantly intense reflections |
0.0656 |
| Weighted residual factors for all reflections included in the refinement |
0.0668 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.054 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/7127987.html