Information card for entry 2229320

Structure parameters

• Chemical name: 1-{5-[(<i>E</i>)-(4-Propylphenyl)diazenyl]-2-hydroxyphenyl}ethanone
• Formula: C17 H18 N2 O2
• Calculated formula: C17 H18 N2 O2
• SMILES: c1(ccc(c(c1)C(=O)C)O)/N=N/c1ccc(cc1)CCC
• Title of publication: 1-{5-[(<i>E</i>)-(4-Propylphenyl)diazenyl]-2-hydroxyphenyl}ethanone
• Authors of publication: Yazıcı, Serap; Albayrak, Çiğdem; Gümrükçüoğlu, Ismail; Şenel, Ismet; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 3
• Pages of publication: o640
• a: 14.8315 ± 0.0005 Å
• b: 7.5573 ± 0.0002 Å
• c: 13.502 ± 0.0004 Å
• α: 90°
• β: 102.578 ± 0.003°
• γ: 90°
• Cell volume: 1477.07 ± 0.08 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0407
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0934
• Weighted residual factors for all reflections included in the refinement: 0.0967
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes