Information card for entry 2207439

Structure parameters

• Chemical name: (E)-5-(4-Ethylphenyldiazenyl)salicylaldehyde
• Formula: C15 H14 N2 O2
• Calculated formula: C15 H14 N2 O2
• SMILES: CCc1ccc(cc1)/N=N/c1ccc(c(c1)C=O)O
• Title of publication: (<i>E</i>)-5-(4-Ethylphenyldiazenyl)salicylaldehyde
• Authors of publication: Şahin, Onur; Albayrak, Çiğdem; Odabaşoğlu, Mustafa; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: o4154 - o4155
• a: 14.2617 ± 0.0012 Å
• b: 13.731 ± 0.002 Å
• c: 6.776 ± 0.003 Å
• α: 90°
• β: 96.958 ± 0.014°
• γ: 90°
• Cell volume: 1317.2 ± 0.6 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: 0.1702
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1442
• Goodness-of-fit parameter for all reflections included in the refinement: 0.836
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No