Information card for entry 2235767

Structure parameters

• Chemical name: (<i>E</i>)-3-Chloro-<i>N</i>-[(2-ethoxynaphthalen-1-yl)methylidene]aniline
• Formula: C19 H16 Cl N O
• Calculated formula: C19 H16 Cl N O
• SMILES: c1cccc2c1ccc(c2/C=N/c1cccc(c1)Cl)OCC
• Title of publication: (<i>E</i>)-3-Chloro-<i>N</i>-[(2-ethoxynaphthalen-1-yl)methylidene]aniline
• Authors of publication: Vesek, Hilal; Kazak, Canan; Alaman Ağar, Ayşen; Macit, Mustafa; Soylu, Mustafa Serkan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: o2518
• a: 8.0084 ± 0.0014 Å
• b: 8.7315 ± 0.0019 Å
• c: 11.7043 ± 0.0008 Å
• α: 76.253 ± 0.013°
• β: 79.794 ± 0.01°
• γ: 84.337 ± 0.017°
• Cell volume: 781 ± 0.2 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0787
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.1801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes