Information card for entry 2223340

Structure parameters

• Chemical name: (<i>E</i>)-3-(4-Fluorophenyl)-1-phenyl-2-propen-1-one
• Formula: C15 H11 F O
• Calculated formula: C15 H11 F O
• SMILES: Fc1ccc(/C=C/C(=O)c2ccccc2)cc1
• Title of publication: (<i>E</i>)-3-(4-Fluorophenyl)-1-phenyl-2-propen-1-one
• Authors of publication: Jing, Lin-Hai
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: o2515
• a: 24.926 ± 0.009 Å
• b: 5.694 ± 0.0019 Å
• c: 7.749 ± 0.003 Å
• α: 90°
• β: 94.747 ± 0.005°
• γ: 90°
• Cell volume: 1096 ± 0.7 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0319
• Weighted residual factors for significantly intense reflections: 0.0651
• Weighted residual factors for all reflections included in the refinement: 0.0663
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes