Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7213117
Preview
Coordinates | 7213117.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 1,1,2,2,6,6,7,7-Octamethyl-1,2,6,7-tetrasilacyclodeca- 3,9-diyne (12) |
---|---|
Formula | C14 H28 Si4 |
Calculated formula | C14 H28 Si4 |
SMILES | [Si]1([Si](C#CC[Si]([Si](CC#C1)(C)C)(C)C)(C)C)(C)C |
Title of publication | Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties |
Authors of publication | Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank |
Journal of publication | Journal of the Chemical Society, Perkin Transactions 2 |
Year of publication | 1999 |
Journal issue | 10 |
Pages of publication | 2093 |
a | 11.139 ± 0.002 Å |
b | 14.468 ± 0.001 Å |
c | 12.472 ± 0.002 Å |
α | 90° |
β | 97.34 ± 0.02° |
γ | 90° |
Cell volume | 1993.5 ± 0.5 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 2 K |
Number of distinct elements | 3 |
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 | 0.051 |
Residual factor for significantly intense reflections | 0.032 |
Weighted residual factors for significantly intense reflections | 0.086 |
Weighted residual factors for all reflections included in the refinement | 0.099 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/7213117.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.