Information card for entry 7227279

Structure parameters

• Formula: C34 H36 N8 O12 Zn3
• Calculated formula: C34 H36 N8 O12 Zn3
• Title of publication: Metal‒organic frameworks with a large breathing effect to host hydroxyl compounds for high anhydrous proton conductivity over a wide temperature range from subzero to 125 °C
• Authors of publication: Ye, Yingxiang; Wu, Xiuzhen; Yao, Zizhu; Wu, Ling; Cai, Zetao; Wang, Lihua; Ma, Xiuling; Chen, Qian-Huo; Zhang, Zhangjing; Xiang, Shengchang
• Journal of publication: J. Mater. Chem. A
• Year of publication: 2016
• Journal volume: 4
• Journal issue: 11
• Pages of publication: 4062 - 4070
• a: 9.1768 ± 0.0005 Å
• b: 10.9017 ± 0.0008 Å
• c: 11.3961 ± 0.0009 Å
• α: 117.938 ± 0.008°
• β: 100.535 ± 0.005°
• γ: 98.517 ± 0.005°
• Cell volume: 953.71 ± 0.15 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0956
• Residual factor for significantly intense reflections: 0.081
• Weighted residual factors for significantly intense reflections: 0.2161
• Weighted residual factors for all reflections included in the refinement: 0.2326
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No