Information card for entry 2221943

Structure parameters

• Chemical name: 3-[(2,4-Dichlorophenyl)iminomethyl]-2-hydroxy-5-methylbenzaldehyde
• Formula: C15 H11 Cl2 N O2
• Calculated formula: C15 H11 Cl2 N O2
• SMILES: c1(c(cc(cc1/C=N/c1c(cc(cc1)Cl)Cl)C)C=O)O
• Title of publication: 3-[(2,4-Dichlorophenyl)iminomethyl]-2-hydroxy-5-methylbenzaldehyde
• Authors of publication: Kılıç, Işın; Işık, Şamil; Ağar, Erbil; Erşahin, Ferda
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1347
• a: 19.424 ± 0.002 Å
• b: 4.6113 ± 0.0003 Å
• c: 15.4245 ± 0.0014 Å
• α: 90°
• β: 103.946 ± 0.008°
• γ: 90°
• Cell volume: 1340.8 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.1487
• Residual factor for significantly intense reflections: 0.0627
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 0.909
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes