Information card for entry 2210169

Structure parameters

• Chemical name: N,N'-Diphenylnaphthalene-1,4-dicarboxamide dimethylacetamide disolvate
• Formula: C32 H36 N4 O4
• Calculated formula: C32 H36 N4 O4
• SMILES: O=C(c1ccc(c2c1cccc2)C(=O)Nc1ccccc1)Nc1ccccc1.CC(=O)N(C)C.CC(=O)N(C)C
• Title of publication: <i>N</i>,<i>N</i>'-Diphenylnaphthalene-1,4-dicarboxamide dimethylacetamide disolvate
• Authors of publication: Ming-Qi Li; Lin-Hai Jing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: o3877 - o3878
• a: 12.307 ± 0.0003 Å
• b: 20.1236 ± 0.0006 Å
• c: 12.121 ± 0.0004 Å
• α: 90°
• β: 108.173 ± 0.001°
• γ: 90°
• Cell volume: 2852.16 ± 0.15 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: 0.051
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes