Information card for entry 2210257

Structure parameters

• Formula: C24 H18 O2
• Calculated formula: C24 H18 O2
• SMILES: O(c1cc2ccc(cc2cc1)/C=C/C(=O)c1ccc2c(c1)cccc2)C
• Title of publication: 3-(6-Methoxy-2-naphthyl)-1-(2-naphthyl)prop-2-en-1-one
• Authors of publication: Yathirajan, H.S.; Sarojini, B.K.; Bindya, S.; Narayana, B.; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o4046 - o4047
• a: 7.527 ± 0.0008 Å
• b: 5.9364 ± 0.0004 Å
• c: 37.576 ± 0.004 Å
• α: 90°
• β: 92.046 ± 0.008°
• γ: 90°
• Cell volume: 1677.9 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes