Information card for entry 2201149

Structure parameters

• Formula: C19 H21 N O3
• Calculated formula: C19 H21 N O3
• SMILES: O=C(NCCc1ccc(OC)c(OC)c1)/C=C/c1ccccc1
• Title of publication: <i>N</i>-[2-(3,4-Dimethoxyphenyl)ethyl]-3-phenylacrylamide
• Authors of publication: Ohba, Shigeru; Ito, Yoshikatsu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 5
• Pages of publication: o517 - o518
• a: 24.449 ± 0.002 Å
• b: 5.2431 ± 0.0005 Å
• c: 12.6633 ± 0.0009 Å
• α: 90°
• β: 91.714 ± 0.006°
• γ: 90°
• Cell volume: 1622.6 ± 0.2 ų
• Cell temperature: 250 ± 1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.26
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes