Information card for entry 7058454

Structure parameters

• Formula: C25 H26 N2 O17
• Calculated formula: C25 H26 N2 O17
• Title of publication: Effect of carbon-skeleton isomerism on the dielectric properties and proton conduction of organic cocrystal compounds assembled from 1,2,4,5-benzenetetracarboxylic acid and piperazine derivatives
• Authors of publication: Liang, Xiaoqiang; Chen, Yixiang; Wang, Li; Zhang, Feng; Fan, Zenglu; Cao, Tingting; Cao, Yaya; Zhu, Huifang; He, Xinyue; Deng, Bolin; You, Yazhi; Dong, Yu; Zhao, Yamei
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 28
• Pages of publication: 11099
• a: 9.609 ± 0.0018 Å
• b: 9.757 ± 0.002 Å
• c: 15.708 ± 0.0012 Å
• α: 71.915 ± 0.002°
• β: 76.613 ± 0.003°
• γ: 87.499 ± 0.002°
• Cell volume: 1361.3 ± 0.4 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0912
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.0762
• Weighted residual factors for all reflections included in the refinement: 0.0817
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No