Information card for entry 2238583

Structure parameters

• Chemical name: 4-Ethoxy-<i>N</i>-(4-ethoxyphenyl)-<i>N</i>-(4-nitrophenyl)aniline
• Formula: C22 H22 N2 O4
• Calculated formula: C22 H22 N2 O4
• SMILES: N(c1ccc(OCC)cc1)(c1ccc(OCC)cc1)c1ccc(N(=O)=O)cc1
• Title of publication: 4-Ethoxy-<i>N</i>-(4-ethoxyphenyl)-<i>N</i>-(4-nitrophenyl)aniline
• Authors of publication: Kong, Ming; Hao, Fu-Ying; Li, Dan-Dan; Wu, Jie-Ying
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 9
• Pages of publication: o1470
• a: 10.926 ± 0.005 Å
• b: 18.38 ± 0.005 Å
• c: 10.345 ± 0.005 Å
• α: 90°
• β: 107.998 ± 0.005°
• γ: 90°
• Cell volume: 1975.8 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.102
• Residual factor for significantly intense reflections: 0.0536
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1778
• Goodness-of-fit parameter for all reflections included in the refinement: 0.975
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes