Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4083603
Preview
Coordinates | 4083603.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | dimethyl[2,4,6-tris(pentafluorophenyl)phenyl]silane |
---|---|
Formula | C26 H9 F15 Si |
Calculated formula | C26 H9 F15 Si |
SMILES | c1(c(cc(cc1c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F)[SiH](C)C |
Title of publication | Polyfluorinated Functionalizedm-Terphenyls. New Substituents and Ligands in Organometallic Synthesis |
Authors of publication | Olaru, Marian; Beckmann, Jens; Raţ, Ciprian I. |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 12 |
Pages of publication | 3012 |
a | 6.3024 ± 0.0013 Å |
b | 11.18 ± 0.002 Å |
c | 17.405 ± 0.004 Å |
α | 90° |
β | 90.49 ± 0.03° |
γ | 90° |
Cell volume | 1226.3 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0702 |
Residual factor for significantly intense reflections | 0.0406 |
Weighted residual factors for significantly intense reflections | 0.08 |
Weighted residual factors for all reflections included in the refinement | 0.0861 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.888 |
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/4083603.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.