Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4312372
Preview
| Coordinates | 4312372.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | tetrakis(mu2-trifluoroacetato-O,O')-bis(diphenyl sulfone-O)-di-rhodium(II,II)), dichloromethane solvate |
|---|---|
| Formula | C34 H24 Cl4 F12 O12 Rh2 S2 |
| Calculated formula | C34 H24 Cl4 F12 O12 Rh2 S2 |
| SMILES | C1(C(F)(F)F)=[O][Rh]234([O]=C(C(F)(F)F)O[Rh]4(O1)([O]=C(O3)C(F)(F)F)([O]=C(C(F)(F)F)O2)[O]=S(c1ccccc1)(=O)c1ccccc1)[O]=S(c1ccccc1)(=O)c1ccccc1.C(Cl)Cl.C(Cl)Cl |
| Title of publication | The First Coordination Complexes of Selenones: A Structural Comparison with Complexes of Sulfones |
| Authors of publication | Evgeny V. Dikarev; Renee Y. Becker; Eric Block; Zhixing Shan; R. Curtis Haltiwanger; Marina A. Petrukhina |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2003 |
| Journal volume | 42 |
| Pages of publication | 7098 - 7105 |
| a | 8.3668 ± 0.0007 Å |
| b | 9.4711 ± 0.0008 Å |
| c | 14.2118 ± 0.0012 Å |
| α | 86.226 ± 0.001° |
| β | 73.887 ± 0.001° |
| γ | 88.154 ± 0.001° |
| Cell volume | 1079.48 ± 0.16 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.04 |
| Residual factor for significantly intense reflections | 0.0344 |
| Weighted residual factors for significantly intense reflections | 0.0826 |
| Weighted residual factors for all reflections included in the refinement | 0.0854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4312372.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.