Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4133807
Preview
| Coordinates | 4133807.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C24 H39 N O3 S Si |
|---|---|
| Calculated formula | C24 H39 N O3 S Si |
| Title of publication | Hydrosilylation-Promoted Furan Diels-Alder Cycloadditions with Stereoselectivity Controlled by the Silyl Group. |
| Authors of publication | Liu, Zhi-Yun; Zhang, Ming; Wang, Xiao-Chen |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2019 |
| a | 11.817 ± 0.002 Å |
| b | 8.055 ± 0.0016 Å |
| c | 27.107 ± 0.005 Å |
| α | 90° |
| β | 100.49 ± 0.03° |
| γ | 90° |
| Cell volume | 2537.1 ± 0.8 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113.15 K |
| Number of distinct elements | 6 |
| 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 | 0.0699 |
| Residual factor for significantly intense reflections | 0.0497 |
| Weighted residual factors for significantly intense reflections | 0.1205 |
| Weighted residual factors for all reflections included in the refinement | 0.1308 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301835 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/13/ Each referenced PubChem compound corresponds to the full crystal structure. |
4133807.cif |
| 245401 | 2019-12-20 | cif/ Adding structures of 4133806, 4133807, 4133808, 4133809 via cif-deposit CGI script. |
4133807.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.