Information card for entry 2226462

Structure parameters

• Chemical name: 2,3-Dimethyl-<i>N</i>-[(<i>E</i>)-4-nitrobenzylidene]aniline
• Formula: C15 H14 N2 O2
• Calculated formula: C15 H14 N2 O2
• SMILES: O=N(=O)c1ccc(/C=N/c2c(c(ccc2)C)C)cc1
• Title of publication: 2,3-Dimethyl-<i>N</i>-[(<i>E</i>)-4-nitrobenzylidene]aniline
• Authors of publication: Tariq, Muhammad Ilyas; Ahmad, Shahbaz; Tahir, M. Nawaz; Sarfaraz, Muhammad; Hussain, Ishtiaq
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1561
• a: 7.1969 ± 0.0005 Å
• b: 11.8023 ± 0.0007 Å
• c: 15.3721 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1305.71 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0875
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes