Information card for entry 1542885

Structure parameters

• Chemical name: 4-Benzyloxy-1,1'-biphenyl
• Formula: C19 H16 O
• Calculated formula: C19 H16 O
• SMILES: O(c1ccc(c2ccccc2)cc1)Cc1ccccc1
• Title of publication: 4-Benzyloxy-1,1'-biphenyl
• Authors of publication: Adam, Farook; Ameram, Nadiah; Kamath, Shevgoor Dhiraj; Pallavi; Samshuddin, Seranthimata
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 3
• Pages of publication: x160398
• a: 31.27 ± 0.002 Å
• b: 5.672 ± 0.0004 Å
• c: 7.8812 ± 0.0005 Å
• α: 90°
• β: 99.271 ± 0.003°
• γ: 90°
• Cell volume: 1379.58 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0965
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 0.867
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes