Information card for entry 2229054

Structure parameters

• Chemical name: <i>N</i>-{4-[(<i>E</i>)-(4-Methylphenyl)iminomethyl]phenyl}acetamide
• Formula: C16 H16 N2 O
• Calculated formula: C16 H16 N2 O
• SMILES: CC(=O)Nc1ccc(cc1)/C=N/c1ccc(cc1)C
• Title of publication: <i>N</i>-{4-[(<i>E</i>)-(4-Methylphenyl)iminomethyl]phenyl}acetamide
• Authors of publication: Tahir, M. Nawaz; Shad, Hazoor Ahmad
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: o443
• a: 7.1044 ± 0.0008 Å
• b: 9.7393 ± 0.001 Å
• c: 10.9236 ± 0.0012 Å
• α: 109.731 ± 0.005°
• β: 91.799 ± 0.006°
• γ: 100.679 ± 0.006°
• Cell volume: 695.51 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0987
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.1117
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes