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Information card for entry 1571582
Preview
| Coordinates | 1571582.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H24 O3 S |
|---|---|
| Calculated formula | C20 H24 O3 S |
| Title of publication | CoH-catalyzed asymmetric remote hydroalkylation of heterocyclic alkenes: a rapid approach to chiral five-membered S- and O-heterocycles. |
| Authors of publication | Zhao, Lingzi; Liu, Feipeng; Zhuang, Yan; Shen, Mengyang; Xue, Jing; Wang, Xuchao; Zhang, Yuting; Rong, Zi-Qiang |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 23 |
| Pages of publication | 8888 - 8895 |
| a | 6.243 ± 0.002 Å |
| b | 8.03 ± 0.003 Å |
| c | 19.073 ± 0.007 Å |
| α | 90° |
| β | 94.875 ± 0.01° |
| γ | 90° |
| Cell volume | 952.7 ± 0.6 Å3 |
| Cell temperature | 193 K |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.104 |
| Residual factor for significantly intense reflections | 0.0922 |
| Weighted residual factors for significantly intense reflections | 0.242 |
| Weighted residual factors for all reflections included in the refinement | 0.2547 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.121 |
| 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 |
|---|---|---|---|
| 292922 (current) | 2024-07-05 | cif/ Updating files of 1571582 Original log message: Adding full bibliography for 1571582.cif. |
1571582.cif |
| 291758 | 2024-05-08 | cif/ Adding structures of 1571582 via cif-deposit CGI script. |
1571582.cif |
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Users of the data should acknowledge the original authors of the
structural data.