Information card for entry 1100237

Structure parameters

• Chemical name: 2,2,2-Trifluoro-1,1-diphenylethanol
• Formula: C14 H11 F3 O
• Calculated formula: C14 H11 F3 O
• SMILES: OC(C(F)(F)F)(c1ccccc1)c1ccccc1
• Authors of publication: Boche, G.; Adler, M.; Adler, S.; Marsch, M.; Harms, K.
• Journal of publication: Private Communication
• Year of publication: 2001
• a: 8.249 ± 0.004 Å
• b: 11.771 ± 0.009 Å
• c: 12.354 ± 0.008 Å
• α: 92.23 ± 0.08°
• β: 98.82 ± 0.07°
• γ: 90.19 ± 0.08°
• Cell volume: 1184.43 ų
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 8.89
• Weighted residual factors for significantly intense reflections: 8.89
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No