Information card for entry 4341430

Structure parameters

• Formula: C8 H19 Mg O12
• Calculated formula: C8 H19 Mg O12
• Title of publication: Alkaline Earth Metal (Mg, Sr, Ba)‒Organic Frameworks Based on 2,2′,6,6′-Tetracarboxybiphenyl for Proton Conduction
• Authors of publication: Dong, Xi-Yan; Hu, Xiao-Peng; Yao, Hong-Chang; Zang, Shuang-Quan; Hou, Hong-Wei; Mak, Thomas C.W.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2014
• Pages of publication: 141103102542005
• a: 19.02 ± 0.002 Å
• b: 7.7962 ± 0.0009 Å
• c: 19.565 ± 0.002 Å
• α: 90°
• β: 92.355 ± 0.01°
• γ: 90°
• Cell volume: 2898.7 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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 all reflections: 0.1197
• Residual factor for significantly intense reflections: 0.0982
• Weighted residual factors for significantly intense reflections: 0.2469
• Weighted residual factors for all reflections included in the refinement: 0.2603
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No