Information card for entry 2009752

Structure parameters

• Common name: 2,2,2-Triphenylethanol
• Chemical name: 2,2,2-Triphenylethanol
• Formula: C20 H18 O
• Calculated formula: C20 H18 O
• SMILES: OCC(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: 2,2,2-Triphenylethanol: a hydrogen-bonded tetramer based upon a centrosymmetric <i>R</i>~4~^4^(8) motif
• Authors of publication: Ferguson, George; Glidewell, Christopher; Zakaria, Choudhury M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 6
• Pages of publication: 928 - 931
• a: 9.2287 ± 0.0009 Å
• b: 14.191 ± 0.0012 Å
• c: 23.2013 ± 0.0015 Å
• α: 90°
• β: 95.835 ± 0.006°
• γ: 90°
• Cell volume: 3022.8 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for all reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.061
• Goodness-of-fit parameter for significantly intense reflections: 1.51
• Diffraction radiation wavelength: 0.71067 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No