Information card for entry 2225168

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(4-nitrophenyl)biphenyl-2,2'-dicarboxamide
• Formula: C26 H18 N4 O6
• Calculated formula: C26 H18 N4 O6
• SMILES: N(=O)(=O)c1ccc(NC(=O)c2ccccc2c2ccccc2C(=O)Nc2ccc(N(=O)=O)cc2)cc1
• Title of publication: <i>N</i>,<i>N</i>'-Bis(4-nitrophenyl)biphenyl-2,2'-dicarboxamide
• Authors of publication: Wang, Gui-Yu; Qin, Da-Bin; Guo, Li-Hui; Luo, Jie-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: o644
• a: 12.568 ± 0.003 Å
• b: 12.003 ± 0.003 Å
• c: 14.858 ± 0.004 Å
• α: 90°
• β: 95.324 ± 0.002°
• γ: 90°
• Cell volume: 2231.7 ± 1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0465
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0923
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes