Information card for entry 2237804

Structure parameters

• Chemical name: 1-[2-(Trityloxy)phenyl]ethanone
• Formula: C27 H22 O2
• Calculated formula: C27 H22 O2
• SMILES: CC(=O)c1ccccc1OC(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: 1-[2-(Trityloxy)phenyl]ethanone
• Authors of publication: Zhao, Pengying
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: o918
• a: 15.6996 ± 0.0017 Å
• b: 8.8767 ± 0.0009 Å
• c: 29.591 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4123.8 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes