Information card for entry 2226404

Structure parameters

• Chemical name: (<i>E</i>)-2-[(4-Iodophenyl)iminomethyl]-6-methylphenol
• Formula: C14 H12 I N O
• Calculated formula: C14 H12 I N O
• SMILES: Ic1ccc(/N=C/c2cccc(c2O)C)cc1
• Title of publication: (<i>E</i>)-2-[(4-Iodophenyl)iminomethyl]-6-methylphenol
• Authors of publication: Özdemir Tarı, Gonca; Ceylan, Umit; Macit, Mustafa; Isık, Şamil
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1568
• a: 4.6773 ± 0.0004 Å
• b: 11.6092 ± 0.0012 Å
• c: 23.6751 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1285.55 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0777
• Goodness-of-fit parameter for all reflections included in the refinement: 0.864
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes