Information card for entry 2221246

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)-2,2-dimethylpropane-1,3-diamine
• Formula: C19 H20 Br2 N2
• Calculated formula: C19 H20 Br2 N2
• SMILES: Brc1ccc(cc1)/C=N/CC(C/N=C/c1ccc(Br)cc1)(C)C
• Title of publication: <i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)-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: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o747
• a: 5.6687 ± 0.0001 Å
• b: 7.7919 ± 0.0002 Å
• c: 41.5932 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1837.17 ± 0.07 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• 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: 0.0533
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes