Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4071170
Preview
Coordinates | 4071170.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H55 I Si4 Sn |
---|---|
Calculated formula | C31 H55 I Si4 Sn |
SMILES | I[Sn]1(C(Cc2ccccc2)c2ccc(cc2)C)C([Si](C)(C)C)([Si](C)(C)C)CCC1([Si](C)(C)C)[Si](C)(C)C |
Title of publication | A Stannylene/Aryl Iodide Reagent for Allylic CH Activation and Double Bond Addition Chemistry |
Authors of publication | Kavara, Ajdin; Cousineau, Kandarpa D.; Rohr, Ahleah D.; Kampf, Jeff W.; Banaszak Holl, Mark M. |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 6 |
Pages of publication | 1041 |
a | 11.554 ± 0.005 Å |
b | 38.173 ± 0.017 Å |
c | 8.728 ± 0.004 Å |
α | 90° |
β | 108.207 ± 0.006° |
γ | 90° |
Cell volume | 3657 ± 3 Å3 |
Cell temperature | 85 ± 2 K |
Ambient diffraction temperature | 85 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0284 |
Residual factor for significantly intense reflections | 0.0276 |
Weighted residual factors for significantly intense reflections | 0.0703 |
Weighted residual factors for all reflections included in the refinement | 0.071 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
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/4071170.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.