Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4113861
Preview
Coordinates | 4113861.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H47 P3 Ru Si2 |
---|---|
Calculated formula | C15 H46 P4 Ru Si |
SMILES | [RuH]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[Si](C)(C)C |
Title of publication | Synthesis and Reactivity of Silyl Ruthenium Complexes: The Importance of Trans Effects in C-H Activation, Si-C Bond Formation, and Dehydrogenative Coupling of Silanes |
Authors of publication | Vladimir K. Dioumaev; Leo J. Procopio; Patrick J. Carroll; Donald H. Berry |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2003 |
Journal volume | 125 |
Pages of publication | 8043 - 8058 |
a | 15.5859 ± 0.0002 Å |
b | 10.8807 ± 0.0001 Å |
c | 29.6653 ± 0.0004 Å |
α | 90° |
β | 103.26 ± 0.004° |
γ | 90° |
Cell volume | 4896.68 ± 0.13 Å3 |
Cell temperature | 210 ± 2 K |
Ambient diffraction temperature | 210 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0444 |
Residual factor for significantly intense reflections | 0.0391 |
Weighted residual factors for all reflections | 0.1024 |
Weighted residual factors for significantly intense reflections | 0.0984 |
Goodness-of-fit parameter for all reflections | 1.125 |
Goodness-of-fit parameter for significantly intense reflections | 1.135 |
Diffraction radiation wavelength | 0.71069 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/4113861.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.