Information card for entry 2209216

Structure parameters

• Chemical name: N-(4-Ethoxyphenyl)-N-[3-(2-nitrophenyl)prop-2-enylidene]amine
• Formula: C17 H16 N2 O3
• Calculated formula: C17 H16 N2 O3
• SMILES: O=N(=O)c1ccccc1/C=C/C=N/c1ccc(OCC)cc1
• Title of publication: <i>N</i>-(4-Ethoxyphenyl)-<i>N</i>-[3-(2-nitrophenyl)prop-2-enylidene]amine
• Authors of publication: Ying Li; Xiao-Yan Yang; Xue-Mei Li; Shu-Sheng Zhang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 6
• Pages of publication: o2389 - o2390
• a: 7.1103 ± 0.001 Å
• b: 7.6318 ± 0.0011 Å
• c: 15.456 ± 0.002 Å
• α: 76.803 ± 0.002°
• β: 81.767 ± 0.002°
• γ: 67.553 ± 0.002°
• Cell volume: 753.23 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1014
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1294
• Weighted residual factors for all reflections included in the refinement: 0.1556
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes