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Information card for entry 4085060
Preview
Coordinates | 4085060.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C39 H31 B2 F15 Si2 |
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Calculated formula | C39 H31 B2 F15 Si2 |
SMILES | [B]123([C@]4([Si](C)(C)C)C(=C(B(c5c(F)c(F)c(F)c(F)c5F)c5c(F)c(F)c(F)c(F)c5F)[C]1([Si](C)(C)C)=[CH]2[C@]34CCC)c1c(F)c(F)c(F)c(F)c1F)c1ccccc1 |
Title of publication | Reactions of Boroles Formed by 1,1-Carboboration |
Authors of publication | Ge, Fang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 1 |
Pages of publication | 229 |
a | 10.5318 ± 0.0003 Å |
b | 10.7243 ± 0.0003 Å |
c | 19.1097 ± 0.0005 Å |
α | 103.289 ± 0.0012° |
β | 91.158 ± 0.0012° |
γ | 114.312 ± 0.0011° |
Cell volume | 1898.17 ± 0.09 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 | 0.0434 |
Residual factor for significantly intense reflections | 0.039 |
Weighted residual factors for significantly intense reflections | 0.0929 |
Weighted residual factors for all reflections included in the refinement | 0.0958 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
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/4085060.html
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