Information card for entry 2233295

Structure parameters

• Chemical name: 4,6-Dichloro-2-{[(<i>E</i>)-(3-{[(<i>E</i>)-3,5-dichloro-2-hydroxybenzylidene]amino}-2,2-dimethylpropyl)imino]methyl}phenol
• Formula: C19 H18 Cl4 N2 O2
• Calculated formula: C19 H18 Cl4 N2 O2
• SMILES: Clc1cc(c(O)c(Cl)c1)/C=N/CC(C)(C)C/N=C/c1c(O)c(Cl)cc(Cl)c1
• Title of publication: 4,6-Dichloro-2-{[(<i>E</i>)-(3-{[(<i>E</i>)-3,5-dichloro-2-hydroxybenzylidene]amino}-2,2-dimethylpropyl)imino]methyl}phenol
• Authors of publication: Kargar, Hadi; Kia, Reza; Abbasian, Saeideh; Tahir, Muhammad Nawaz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 1
• Pages of publication: o142
• a: 16.5265 ± 0.0005 Å
• b: 10.3242 ± 0.0003 Å
• c: 12.6433 ± 0.0004 Å
• α: 90°
• β: 104.796 ± 0.001°
• γ: 90°
• Cell volume: 2085.71 ± 0.11 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: 0.0691
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.104
• Weighted residual factors for all reflections included in the refinement: 0.1187
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes