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Information card for entry 7118202
Preview
Coordinates | 7118202.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H6 B F15 O |
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Calculated formula | C25 H6 B F15 O |
SMILES | [B]([O]=Cc1ccccc1)(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 |
Title of publication | Cyclopropane formation under frustrated Lewis pair conditions. |
Authors of publication | Krupski, Sergei; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2016 |
Journal volume | 52 |
Journal issue | 13 |
Pages of publication | 2695 - 2697 |
a | 9.4516 ± 0.0004 Å |
b | 12.1427 ± 0.0005 Å |
c | 12.2399 ± 0.0004 Å |
α | 110.414 ± 0.001° |
β | 100.07 ± 0.001° |
γ | 97.111 ± 0.001° |
Cell volume | 1269.99 ± 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 | 0.0466 |
Residual factor for significantly intense reflections | 0.036 |
Weighted residual factors for significantly intense reflections | 0.0929 |
Weighted residual factors for all reflections included in the refinement | 0.0979 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7118202.html
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