Information card for entry 2223608

Structure parameters

• Chemical name: (3<i>E</i>,5<i>E</i>)-1-Benzyl-3,5-dibenzylidenepiperidin-4-one
• Formula: C26 H23 N O
• Calculated formula: C26 H23 N O
• SMILES: N1(CC(=C\c2ccccc2)/C(=O)/C(=C/c2ccccc2)C1)Cc1ccccc1
• Title of publication: (3<i>E</i>,5<i>E</i>)-1-Benzyl-3,5-dibenzylidenepiperidin-4-one
• Authors of publication: Karthikeyan, N. S.; Sathiyanarayanan, K.; Aravindan, P. G.; Rathore, R. S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: o2775
• a: 6.3354 ± 0.0004 Å
• b: 10.2365 ± 0.0006 Å
• c: 15.7885 ± 0.0009 Å
• α: 75.245 ± 0.002°
• β: 87.651 ± 0.003°
• γ: 88.699 ± 0.003°
• Cell volume: 989.24 ± 0.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0938
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1752
• Weighted residual factors for all reflections included in the refinement: 0.2016
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes