Information card for entry 2207868

Structure parameters

• Chemical name: (E)-2-Acetyl-4-[(3-chlorophenyl)diazenyl]phenol
• Formula: C14 H11 Cl N2 O2
• Calculated formula: C14 H11 Cl N2 O2
• SMILES: c1(cc(C(=O)C)c(cc1)O)/N=N/c1cc(ccc1)Cl
• Title of publication: (<i>E</i>)-2-Acetyl-4-[(3-chlorophenyl)diazenyl]phenol
• Authors of publication: Özdemir, Gonca; Işık, Şamil; Albayrak, Çiğdem; Ağar, Erbil
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: o342 - o343
• a: 8.4663 ± 0.0015 Å
• b: 11.236 ± 0.003 Å
• c: 13.955 ± 0.003 Å
• α: 90°
• β: 103.914 ± 0.014°
• γ: 90°
• Cell volume: 1288.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0775
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1207
• Weighted residual factors for all reflections included in the refinement: 0.1339
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes