Information card for entry 2009260

Structure parameters

• Chemical name: N-benzyl-N-(p-tolyl)cinnamamide
• Formula: C23 H21 N O
• Calculated formula: C23 H21 N O
• SMILES: c1(ccccc1)/C=C/C(=O)N(Cc1ccccc1)c1ccc(cc1)C
• Title of publication: <i>N</i>-Benzyl-<i>N</i>-(2-iodo-4-methylphenyl)cinnamamide and <i>N</i>-benzyl-<i>N</i>-(<i>p</i>-tolyl)cinnamamide
• Authors of publication: Shanmuga Sundara Raj, S.; Renganayaki, S.; Subramanian, E.; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 12
• Pages of publication: 2182 - 2184
• a: 15.1665 ± 0.0016 Å
• b: 6.2451 ± 0.0006 Å
• c: 19.946 ± 0.002 Å
• α: 90°
• β: 99.65 ± 0.002°
• γ: 90°
• Cell volume: 1862.5 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.146
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No