Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4065438
Preview
Coordinates | 4065438.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H36 F3 O3 P Ru S |
---|---|
Calculated formula | C20 H36 F3 O3 P Ru S |
SMILES | [Ru]1234([P](C(C)C)(C(C)C)C(C)C)(OS(=O)(=O)C(F)(F)F)[c]5([c]1([c]2([c]4([c]35C)C)C)C)C |
Title of publication | Cp*(PiPr3)RuOTf: A Reagent for Access to Ruthenium Silylene Complexes |
Authors of publication | Fasulo, Meg E.; Glaser, Paul B.; Tilley, T. Don |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 20 |
Pages of publication | 5524 |
a | 17.831 ± 0.0008 Å |
b | 14.923 ± 0.0007 Å |
c | 18.082 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4811.5 ± 0.4 Å3 |
Cell temperature | 138 ± 2 K |
Ambient diffraction temperature | 138 ± 2 K |
Number of distinct elements | 7 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0597 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0689 |
Weighted residual factors for all reflections included in the refinement | 0.0767 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
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/4065438.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.