Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7250323
Preview
| Coordinates | 7250323.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H12 Cl6 N2 Sn |
|---|---|
| Calculated formula | C12 H12 Cl6 N2 Sn |
| Title of publication | Photosalient [2+2] Photodimerization in Metal Chloride-Templated Organic Crystals |
| Authors of publication | Kusumoto, Sotaro; Usuda, Kippei; Rakumitsu, Kenta; Kim, Yang; Koide, Yoshihiro |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 7.1093 ± 0.0003 Å |
| b | 14.9953 ± 0.0005 Å |
| c | 32.2219 ± 0.0013 Å |
| α | 90° |
| β | 91.529 ± 0.003° |
| γ | 90° |
| Cell volume | 3433.8 ± 0.2 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0459 |
| Residual factor for significantly intense reflections | 0.0357 |
| Weighted residual factors for significantly intense reflections | 0.0656 |
| Weighted residual factors for all reflections included in the refinement | 0.0679 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.0602 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299388 (current) | 2025-04-25 | cif/ Adding structures of 7250320, 7250321, 7250322, 7250323, 7250324 via cif-deposit CGI script. |
7250323.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.