Information card for entry 2220929

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)biphenyl-2,2'-diamine
• Formula: C26 H18 Br2 N2
• Calculated formula: C26 H18 Br2 N2
• SMILES: Brc1ccc(cc1)/C=N/c1ccccc1c1ccccc1/N=C/c1ccc(cc1)Br
• Title of publication: <i>N</i>,<i>N</i>'-Bis(4-bromobenzylidene)biphenyl-2,2'-diamine
• Authors of publication: Dehghanpour, Saeed; Asadizadeh, Saeedeh; Gao, Shan; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o306
• a: 15.9691 ± 0.001 Å
• b: 8.3482 ± 0.0005 Å
• c: 16.7767 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2236.6 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 41
• Hermann-Mauguin space group symbol: A b a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.085
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 0.98
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes