Information card for entry 2214974

Structure parameters

• Chemical name: <i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)anthracene-1,8-dicarboxamide
• Formula: C30 H24 N2 O4
• Calculated formula: C30 H24 N2 O4
• SMILES: O=C(Nc1ccccc1OC)c1cccc2cc3cccc(c3cc12)C(=O)Nc1ccccc1OC
• Title of publication: <i>N</i>,<i>N</i>'-Bis(2-methoxyphenyl)anthracene-1,8-dicarboxamide
• Authors of publication: Gao, En; He, Rui; Zhang, Huan-Xia; Qin, Da-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o3816 - o3816
• a: 13.131 ± 0.003 Å
• b: 11.864 ± 0.002 Å
• c: 14.911 ± 0.003 Å
• α: 90°
• β: 91.13 ± 0.03°
• γ: 90°
• Cell volume: 2322.5 ± 0.8 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.1042
• Weighted residual factors for all reflections included in the refinement: 0.1065
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes