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CIF Information Card
Information card for 7101776
7101775 << 7101776 >> 7101777Preview
|
Coordinates |
7101776.cif |
Structure parameters
| Formula | - C38 H40 B Cl3 F P - |
| Calculated formula | - C38 H40 B Cl3 F P - |
| Title of publication | Fluoride ion complexation by a cationic borane in aqueous solution. |
| Authors of publication | Lee, Min Hyung; Agou, Tomohiro; Kobayashi, Junji; Kawashima, Takayuki; Gabbaï, François P |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 11 |
| Pages of publication | 1133 - 1135 |
| a | 12.2069 ± 0.0011 Å |
| b | 12.6236 ± 0.0012 Å |
| c | 13.1483 ± 0.0012 Å |
| α | 71.916 ± 0.002° |
| β | 76.183 ± 0.002° |
| γ | 62.797 ± 0.002° |
| Cell volume | 1701.7 ± 0.3 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.11 |
| Residual factor for observed reflections | 0.066 |
| Weighted residual factors for the observed reflections | 0.1342 |
| Weighted residual factors for all reflections included in the refinement | 0.163 |
| Goodness-of-fit parameter for observed reflections | 1.004 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |