Information card for entry 2234413

Structure parameters

• Chemical name: (<i>E</i>)-4-[(4-Diethylamino-2-hydroxybenzylidene)amino]benzoic acid
• Formula: C18 H20 N2 O3
• Calculated formula: C18 H20 N2 O3
• SMILES: CCN(c1ccc(c(c1)O)/C=N/c1ccc(cc1)C(=O)O)CC
• Title of publication: (<i>E</i>)-4-[(4-Diethylamino-2-hydroxybenzylidene)amino]benzoic acid
• Authors of publication: Kargar, Hadi; Sharafi, Zahra; Kia, Reza; Tahir, Muhammad Nawaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: o1036
• a: 12.4216 ± 0.0008 Å
• b: 8.1511 ± 0.0006 Å
• c: 16.082 ± 0.0011 Å
• α: 90°
• β: 93.001 ± 0.003°
• γ: 90°
• Cell volume: 1626.06 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.2308
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.1327
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes