Information card for entry 2011545

Structure parameters

• Formula: C28 H24 N2 O10
• Calculated formula: C28 H24 N2 O10
• SMILES: OC(=O)c1cc(C(=O)O)c(cc1C(=O)O)C(=O)O.NC(=O)/C=C/c1ccccc1.NC(=O)/C=C/c1ccccc1
• Title of publication: Benzene-1,2,4,5-tetracarboxylic acid‒<i>trans</i>-cinnamamide(1/2)
• Authors of publication: Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 11
• Pages of publication: e511 - e511
• a: 7.163 ± 0.002 Å
• b: 39.861 ± 0.009 Å
• c: 10.053 ± 0.003 Å
• α: 90°
• β: 107.4 ± 0.02°
• γ: 90°
• Cell volume: 2739 ± 1.3 ų
• Cell temperature: 298 ± 1 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for all reflections included in the refinement: 0.158
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes