Information card for entry 2232784

Structure parameters

• Common name: 1-(4-(benzyloxy)-2-hydroxyphenyl)ethanone
• Chemical name: 1-(4-Benzyloxy-2-hydroxyphenyl)ethanone
• Formula: C15 H14 O3
• Calculated formula: C15 H14 O3
• SMILES: O=C(C)c1c(O)cc(OCc2ccccc2)cc1
• Title of publication: 1-(4-Benzyloxy-2-hydroxyphenyl)ethanone
• Authors of publication: Ma, Ya-Tuan; Yang, Chong-Lin; Li, Zhen-Shuo; Li, Zhong-Qiang; Ding, Juan-Ning
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: o3225
• a: 5.8433 ± 0.0007 Å
• b: 8.0096 ± 0.0008 Å
• c: 13.8089 ± 0.0013 Å
• α: 74.061 ± 0.001°
• β: 84.589 ± 0.001°
• γ: 87.372 ± 0.002°
• Cell volume: 618.54 ± 0.11 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes