Information card for entry 2229083

Structure parameters

• Chemical name: (<i>E</i>)-1-{2-Hydroxy-5-[(4-methylphenyl)diazenyl]phenyl}ethanone
• Formula: C15 H14 N2 O2
• Calculated formula: C15 H14 N2 O2
• SMILES: c1cc(ccc1C)/N=N/c1ccc(c(c1)C(=O)C)O
• Title of publication: (<i>E</i>)-1-{2-Hydroxy-5-[(4-methylphenyl)diazenyl]phenyl}ethanone
• Authors of publication: Çapan, Yasemin; Kazak, Canan; Ağar, Ayşen; Macit, Mustafa
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: o429
• a: 7.0919 ± 0.0007 Å
• b: 7.0842 ± 0.0007 Å
• c: 13.4094 ± 0.0013 Å
• α: 92.722 ± 0.008°
• β: 93.045 ± 0.008°
• γ: 101.926 ± 0.009°
• Cell volume: 657.04 ± 0.11 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.211
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.1
• Goodness-of-fit parameter for all reflections included in the refinement: 0.818
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes