Information card for entry 2241318

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>-[(2-Methoxynaphthalen-1-yl)methylidene]-3-nitroaniline
• Formula: C18 H14 N2 O3
• Calculated formula: C18 H14 N2 O3
• Title of publication: Crystal structure of (<i>E</i>)-<i>N</i>-[(2-methoxynaphthalen-1-yl)methylidene]-3-nitroaniline
• Authors of publication: Bhai R., Devika; Girija, C. R.; Suresh, Shalini; Reddy, Ramakrishna
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 12
• Pages of publication: o941 - o942
• a: 12.8481 ± 0.0007 Å
• b: 15.4085 ± 0.0006 Å
• c: 7.6232 ± 0.0003 Å
• α: 90°
• β: 98.04 ± 0.004°
• γ: 90°
• Cell volume: 1494.33 ± 0.12 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: 0.1019
• Residual factor for significantly intense reflections: 0.0548
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes