Information card for entry 2222951

Structure parameters

• Common name: triphenylmethyl benzoate
• Chemical name: Triphenylmethyl benzoate
• Formula: C26 H20 O2
• Calculated formula: C26 H20 O2
• SMILES: O(C(=O)c1ccccc1)C(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Triphenylmethyl benzoate
• Authors of publication: Sykora, Richard E.; McDonald, Lane; Spyridis, Greg T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o2026
• a: 8.9512 ± 0.0004 Å
• b: 14.9545 ± 0.0005 Å
• c: 14.4038 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1928.1 ± 0.13 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Cell measurement pressure: 101.3 kPa
• Number of distinct elements: 3
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0586
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0662
• Weighted residual factors for all reflections included in the refinement: 0.0704
• Goodness-of-fit parameter for all reflections included in the refinement: 0.906
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes