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Information card for entry 4120678
Preview
Coordinates | 4120678.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H23 B2 F15 Si2 |
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Calculated formula | C34 H23 B2 F15 Si2 |
SMILES | [Si](C1B(C([Si](C)(C)C)=C(C=1B(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1ccccc1)(C)(C)C |
Title of publication | Borole formation by 1,1-carboboration. |
Authors of publication | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 1 |
Pages of publication | 68 - 71 |
a | 10.8632 ± 0.0004 Å |
b | 11.8992 ± 0.0006 Å |
c | 14.8632 ± 0.0009 Å |
α | 81.215 ± 0.004° |
β | 84.155 ± 0.003° |
γ | 68.825 ± 0.003° |
Cell volume | 1768.26 ± 0.16 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 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 | 0.0744 |
Residual factor for significantly intense reflections | 0.0481 |
Weighted residual factors for significantly intense reflections | 0.117 |
Weighted residual factors for all reflections included in the refinement | 0.1328 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
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/4120678.html
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Users of the data should acknowledge the original authors of the
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