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Information card for entry 4122592
Preview
Coordinates | 4122592.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | spiro[2,2,5,5-tetra-tert-butyl-3,3,4,4-tetramethyl-bicyclo[4.1.0]heptasil-1(6)- ene-7,1'-2,2,5,5-tetra-tert-butyl-3,3,4,4-tetramethylcyclopentasilane] |
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Formula | C40 H96 Si11 |
Calculated formula | C40 H96 Si11 |
SMILES | [Si]1([Si]2([Si]([Si]([Si]1(C)C)(C)C)(C(C)(C)C)C(C)(C)C)[Si]1=[Si]2[Si]([Si]([Si]([Si]1(C(C)(C)C)C(C)(C)C)(C)C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C |
Title of publication | Tetrasilane-bridged bicyclo[4.1.0]heptasil-1(6)-ene. |
Authors of publication | Tsurusaki, Akihiro; Kamiyama, Jun; Kyushin, Soichiro |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 37 |
Pages of publication | 12896 - 12898 |
a | 12.0612 ± 0.0016 Å |
b | 14.318 ± 0.002 Å |
c | 18.484 ± 0.002 Å |
α | 101.875 ± 0.003° |
β | 97.825 ± 0.002° |
γ | 111.173 ± 0.003° |
Cell volume | 2834.3 ± 0.6 Å3 |
Cell temperature | 183 ± 2 K |
Ambient diffraction temperature | 183 ± 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 | 0.0488 |
Residual factor for significantly intense reflections | 0.0443 |
Weighted residual factors for significantly intense reflections | 0.1176 |
Weighted residual factors for all reflections included in the refinement | 0.1355 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.137 |
Diffraction radiation wavelength | 0.7107 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/4122592.html
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