Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7043131
Preview
Coordinates | 7043131.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Trispyridylphosphine antimony tris triflate |
---|---|
Chemical name | Trispyridylphosphine antimony tris triflate |
Formula | C19 H13.5 F9 N3.5 O9 P S3 Sb |
Calculated formula | C19 H13.5 F9 N3.5 O9 P S3 Sb |
SMILES | [Sb]12(OS(=O)(=O)C(F)(F)F)([n]3ccccc3P(c3[n]2cccc3)c2[n]1cccc2)(OS(=O)(=O)C(F)(F)F)OS(=O)(C(F)(F)F)=O.N#CC |
Title of publication | Tris(2-pyridyl)phosphine as a versatile ligand for pnictogen acceptors |
Authors of publication | Suter, Riccardo; Sinclair, Hannah; Burford, Neil; McDonald, Robert; Ferguson, Michael J.; Schrader, Erik |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 21.6061 ± 0.0002 Å |
b | 12.18356 ± 0.0001 Å |
c | 21.5114 ± 0.0002 Å |
α | 90° |
β | 91.2212 ± 0.0009° |
γ | 90° |
Cell volume | 5661.36 ± 0.09 Å3 |
Cell temperature | 100.01 ± 0.1 K |
Ambient diffraction temperature | 100.01 ± 0.1 K |
Number of distinct elements | 8 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0168 |
Residual factor for significantly intense reflections | 0.0165 |
Weighted residual factors for significantly intense reflections | 0.0391 |
Weighted residual factors for all reflections included in the refinement | 0.0392 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Diffraction radiation X-ray symbol | K-L~3~ |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7043131.html
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.