Information card for entry 2231573

Structure parameters

• Common name: <i>N</i>,<i>N</i>'-Bis(2,5-dichlorophenyl)isophthalamide
• Chemical name: <i>N</i>,<i>N</i>'-bis(2,5-dichlorophenyl)benzene-1,3-dicarboxamide
• Formula: C20 H12 Cl4 N2 O2
• Calculated formula: C20 H12 Cl4 N2 O2
• SMILES: O=C(c1cccc(c1)C(=O)Nc1cc(Cl)ccc1Cl)Nc1cc(Cl)ccc1Cl
• Title of publication: <i>N</i>,<i>N</i>'-Bis(2,5-dichlorophenyl)isophthalamide
• Authors of publication: Zhu, Ruitao; Dong, Jinlong; Zuo, Yu; Ren, Yuehong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2311
• a: 11.3661 ± 0.0011 Å
• b: 10.0239 ± 0.0009 Å
• c: 8.947 ± 0.0007 Å
• α: 90°
• β: 109.988 ± 0.001°
• γ: 90°
• Cell volume: 957.95 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0688
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.1104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes