Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7154079
Preview
Coordinates | 7154079.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H24 Si |
---|---|
Calculated formula | C21 H24 Si |
SMILES | [Si](C1C(=C(C)C)C=CC1)(C)(c1ccccc1)c1ccccc1 |
Title of publication | Frustrated Lewis pair catalyzed hydrosilylation and hydrosilane mediated hydrogenation of fulvenes. |
Authors of publication | Tamke, Sergej; Daniliuc, Constantin-G; Paradies, Jan |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2014 |
Journal volume | 12 |
Journal issue | 45 |
Pages of publication | 9139 - 9144 |
a | 7.5625 ± 0.0006 Å |
b | 8.5844 ± 0.0006 Å |
c | 14.9024 ± 0.0015 Å |
α | 105.447 ± 0.004° |
β | 98.731 ± 0.005° |
γ | 99.813 ± 0.004° |
Cell volume | 898.84 ± 0.13 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0626 |
Residual factor for significantly intense reflections | 0.0568 |
Weighted residual factors for significantly intense reflections | 0.1526 |
Weighted residual factors for all reflections included in the refinement | 0.1581 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/7154079.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.