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Information card for entry 4122104
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Coordinates | 4122104.cif |
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Original paper (by DOI) | HTML |
Common name | Tetrachlorodisilene stabilized by cAAC |
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Formula | C46 H70 Cl4 N2 Si2 |
Calculated formula | C46 H70 Cl4 N2 Si2 |
SMILES | C1(C2(CC(N1c1c(cccc1C(C)C)C(C)C)(C)C)CCCCC2)=[Si](Cl)(Cl)[Si](=C1C2(CC(N1c1c(cccc1C(C)C)C(C)C)(C)C)CCCCC2)(Cl)Cl |
Title of publication | Cyclic Alkyl(amino) Carbene Stabilized Biradical of Disilicontetrachloride. |
Authors of publication | Mondal, Kartik Chandra; Dittrich, Birger; Maity, Bholanath; Koley, Debasis; Roesky, Herbert W. |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 27 |
Pages of publication | 9568 - 9571 |
a | 9.25 ± 0.003 Å |
b | 10.658 ± 0.01 Å |
c | 12.088 ± 0.009 Å |
α | 100.23 ± 0.05° |
β | 99.97 ± 0.03° |
γ | 91.24 ± 0.04° |
Cell volume | 1153.4 ± 1.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0621 |
Residual factor for significantly intense reflections | 0.0598 |
Weighted residual factors for significantly intense reflections | 0.2236 |
Weighted residual factors for all reflections included in the refinement | 0.2245 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.143 |
Diffraction radiation wavelength | 0.7293 Å |
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/4122104.html
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