Information card for entry 2220110

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis-(2,4-dichlorobenzylidene)-2,2-dimethylpropane-1,3-diamine
• Formula: C19 H18 Cl4 N2
• Calculated formula: C19 H18 Cl4 N2
• SMILES: Clc1ccc(c(c1)Cl)/C=N/CC(C/N=C/c1ccc(cc1Cl)Cl)(C)C
• Title of publication: <i>N</i>,<i>N</i>'-Bis-(2,4-dichlorobenzylidene)-2,2-dimethylpropane-1,3-diamine
• Authors of publication: Kia, Reza; Fun, Hoong-Kun; Kargar, Hadi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2285
• a: 30.7633 ± 0.0004 Å
• b: 5.4012 ± 0.0001 Å
• c: 11.4532 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1903.05 ± 0.05 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 54
• Hermann-Mauguin space group symbol: P c c a
• Hall space group symbol: -P 2a 2ac
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.0986
• Goodness-of-fit parameter for all reflections included in the refinement: 1.191
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes