Information card for entry 4030484

Structure parameters

• Formula: C5 H9 B F11 P S
• Calculated formula: C5 H9 B F11 P S
• SMILES: S(F)(F)(F)(F)(F)C(=C(\[P+](C)(C)C)F)\F.[B](F)(F)(F)[F-]
• Title of publication: The improved preparation of (E)-SF5CF=CFI and the crystal structure of [SF5CF=CFP(CH3)3]+BF4-
• Authors of publication: Wessolowski, H.; Roschenthaler, G.-V.; Winter, R.; Gard, G. L.; Pon, G.; Willett, R.
• Journal of publication: European Journal of Solid State and Inorganic Chemistry
• Year of publication: 1992
• Journal volume: 29
• Pages of publication: 1173 - 1187
• a: 7.282 ± 0.003 Å
• b: 12.23 ± 0.004 Å
• c: 14.226 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1267 ± 0.7 ų
• Ambient diffraction temperature: 163 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.0863
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No