Information card for entry 2222642

Structure parameters

• Chemical name: (<i>E</i>)-3-[(4-Butylphenyl)iminomethyl]benzene-1,2-diol
• Formula: C17 H19 N O2
• Calculated formula: C17 H19 N O2
• SMILES: c1(c(c(ccc1)O)O)/C=N/c1ccc(cc1)CCCC
• Title of publication: (<i>E</i>)-3-[(4-Butylphenyl)iminomethyl]benzene-1,2-diol
• Authors of publication: Keleşoğlu, Zeynep; Büyükgüngör, Orhan; Albayrak, Çiğdem; Odabaşoğlu, Mustafa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 8
• Pages of publication: o2022
• a: 16.2774 ± 0.0013 Å
• b: 6.0148 ± 0.0006 Å
• c: 17.6166 ± 0.0014 Å
• α: 90°
• β: 121.476 ± 0.005°
• γ: 90°
• Cell volume: 1471 ± 0.2 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.1266
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes