Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1570102
Preview
| Coordinates | 1570102.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H15 B Cl N |
|---|---|
| Calculated formula | C7 H15 B Cl N |
| Title of publication | Programmable synthesis of difluorinated hydrocarbons from alkenes through a photocatalytic linchpin strategy. |
| Authors of publication | Zhang, Zhi-Qi; Wang, Cheng-Qiang; Li, Long-Ji; Piper, Jared L.; Peng, Zhi-Hui; Ma, Jun-An; Zhang, Fa-Guang; Wu, Jie |
| Journal of publication | Chemical science |
| Year of publication | 2023 |
| Journal volume | 14 |
| Journal issue | 41 |
| Pages of publication | 11546 - 11553 |
| a | 12.9872 ± 0.0008 Å |
| b | 12.2112 ± 0.0007 Å |
| c | 10.7243 ± 0.0006 Å |
| α | 90° |
| β | 91.52 ± 0.002° |
| γ | 90° |
| Cell volume | 1700.16 ± 0.17 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0438 |
| Residual factor for significantly intense reflections | 0.0406 |
| Weighted residual factors for significantly intense reflections | 0.1082 |
| Weighted residual factors for all reflections included in the refinement | 0.1112 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287293 (current) | 2023-11-06 | cif/ Updating files of 1570102 Original log message: Adding full bibliography for 1570102.cif. |
1570102.cif |
| 286933 | 2023-10-13 | cif/ Adding structures of 1570102 via cif-deposit CGI script. |
1570102.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.