Information card for entry 2220932

Structure parameters

• Chemical name: <i>N</i>-{2-[2-(2,6-Dichloro-3,5-dimethoxyphenyl)ethenyl]phenyl}acetamide
• Formula: C18 H17 Cl2 N O3
• Calculated formula: C18 H17 Cl2 N O3
• SMILES: Clc1c(c(Cl)c(OC)cc1OC)/C=C/c1ccccc1NC(=O)C
• Title of publication: <i>N</i>-{2-[2-(2,6-Dichloro-3,5-dimethoxyphenyl)ethenyl]phenyl}acetamide
• Authors of publication: Ahmad, Kartini; Awang, Khalijah; Thomas, Noel F.; Weber, Jean-Frederic Faizal; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o438
• a: 7.5646 ± 0.0003 Å
• b: 9.1485 ± 0.0003 Å
• c: 12.2969 ± 0.0005 Å
• α: 78.561 ± 0.002°
• β: 77.716 ± 0.002°
• γ: 85.969 ± 0.003°
• Cell volume: 814.65 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.075
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.117
• Goodness-of-fit parameter for all reflections included in the refinement: 0.99
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes