Information card for entry 2237771

Structure parameters

• Chemical name: <i>N</i>-[4-(Dimethylamino)benzylidene]-4-methylaniline
• Formula: C16 H18 N2
• Calculated formula: C16 H18 N2
• SMILES: Cc1ccc(cc1)/N=C/c1ccc(cc1)N(C)C
• Title of publication: <i>N</i>-[4-(Dimethylamino)benzylidene]-4-methylaniline
• Authors of publication: Balachandar, R. K.; Kalainathan, S.; Eappen, Shibu M.; Podder, Jiban
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 6
• Pages of publication: o905
• a: 10.4814 ± 0.001 Å
• b: 8.0528 ± 0.0008 Å
• c: 32.571 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2749.1 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0981
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.1578
• Weighted residual factors for all reflections included in the refinement: 0.1865
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes