Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7132773
Preview
| Coordinates | 7132773.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H12 Br4 N2 O4 Pb S2 |
|---|---|
| Calculated formula | C12 H12 Br4 N2 O4 Pb S2 |
| Title of publication | 1D Pb halide perovskite-like materials for high performance X-ray detection. |
| Authors of publication | Wang, Jing; Yang, Jin-Hai; Chen, Jie; Wang, Shuai-Hua; Chen, Yong-Jun; Xu, Gang |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2024 |
| Journal volume | 60 |
| Journal issue | 24 |
| Pages of publication | 3311 - 3314 |
| a | 4.4621 ± 0.0004 Å |
| b | 19.0334 ± 0.0017 Å |
| c | 12.5804 ± 0.0013 Å |
| α | 90° |
| β | 98.489 ± 0.004° |
| γ | 90° |
| Cell volume | 1056.73 ± 0.17 Å3 |
| Cell temperature | 300 ± 2 K |
| Ambient diffraction temperature | 299.97 K |
| Number of distinct elements | 7 |
| 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 | 0.0611 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.0569 |
| Weighted residual factors for all reflections included in the refinement | 0.0677 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 290808 (current) | 2024-04-05 | cif/ Updating files of 7132772, 7132773, 7132774 Original log message: Adding full bibliography for 7132772--7132774.cif. |
7132773.cif |
| 289966 | 2024-02-28 | cif/ Adding structures of 7132772, 7132773, 7132774 via cif-deposit CGI script. |
7132773.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.