Information card for entry 2213905

Structure parameters

• Chemical name: N-[3-(2-Nitrophenyl)allylidene]naphthalen-1-amine
• Formula: C19 H14 N2 O2
• Calculated formula: C19 H14 N2 O2
• SMILES: c12c(/N=C/C=C/c3c(N(=O)=O)cccc3)cccc1cccc2
• Title of publication: <i>N</i>-[3-(2-Nitrophenyl)allylidene]naphthalen-1-amine
• Authors of publication: Xiao-Yan Yang; Xiao-Lian He; Ying Li; Sai Bi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: o2919 - o2919
• a: 15.44 ± 0.002 Å
• b: 7.4165 ± 0.001 Å
• c: 14.598 ± 0.002 Å
• α: 90°
• β: 117.347 ± 0.002°
• γ: 90°
• Cell volume: 1484.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.073
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.1237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes