Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7134256
Preview
| Coordinates | 7134256.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56.5 H49 F3 O4 P2 S2 |
|---|---|
| Calculated formula | C56.5 H49 F3 O4 P2 S2 |
| Title of publication | Bicyclic sulfonium pincer ligand with a thiatriptycenium backbone-synthesis and applications in π-acid catalysis. |
| Authors of publication | Zafar, Mohammad; Shamali, Donia; Barel, Nitsan; Danovich, David; Tulchinsky, Yuri |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2025 |
| Journal volume | 61 |
| Journal issue | 23 |
| Pages of publication | 4559 - 4562 |
| a | 10.0296 ± 0.0003 Å |
| b | 12.2752 ± 0.0003 Å |
| c | 22.7212 ± 0.0006 Å |
| α | 80.179 ± 0.002° |
| β | 80.228 ± 0.002° |
| γ | 67.613 ± 0.003° |
| Cell volume | 2531.69 ± 0.13 Å3 |
| Cell temperature | 200 ± 0.1 K |
| Ambient diffraction temperature | 200 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0657 |
| Residual factor for significantly intense reflections | 0.0472 |
| Weighted residual factors for significantly intense reflections | 0.124 |
| Weighted residual factors for all reflections included in the refinement | 0.1322 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298781 (current) | 2025-04-05 | cif/ Updating files of 7134256 Original log message: Adding full bibliography for 7134256.cif. |
7134256.cif |
| 297668 | 2025-02-11 | cif/ Adding structures of 7134256 via cif-deposit CGI script. |
7134256.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.