Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1546248
Preview
| Coordinates | 1546248.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73 H152 K N2 O22 S Si4 U |
|---|---|
| Calculated formula | C73 H152 K N2 O22 S Si4 U |
| Title of publication | Metathesis of a UV imido complex: a route to a terminal UV sulfide |
| Authors of publication | Kelly, Rory P.; Falcone, Marta; Lamsfus, Carlos Alvarez; Scopelliti, Rosario; Maron, Laurent; Meyer, Karsten; Mazzanti, Marinella |
| Journal of publication | Chem. Sci. |
| Year of publication | 2017 |
| a | 14.4445 ± 0.0004 Å |
| b | 14.4565 ± 0.0006 Å |
| c | 47.0418 ± 0.0018 Å |
| α | 82.352 ± 0.003° |
| β | 84.245 ± 0.003° |
| γ | 78.583 ± 0.003° |
| Cell volume | 9515.4 ± 0.6 Å3 |
| Cell temperature | 100.01 ± 0.1 K |
| Ambient diffraction temperature | 100.01 ± 0.1 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0931 |
| Residual factor for significantly intense reflections | 0.0906 |
| Weighted residual factors for significantly intense reflections | 0.2307 |
| Weighted residual factors for all reflections included in the refinement | 0.232 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197542 (current) | 2017-06-06 | cif/ Adding structures of 1546246, 1546247, 1546248, 1546249, 1546250 via cif-deposit CGI script. |
1546248.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.