Information card for entry 7220163

Structure parameters

• Formula: C84 H158 Cu3 N24 O170 P4 W36
• Calculated formula: C84 H84 Cu3 N24 O142 P4 W36
• Title of publication: A novel polyoxometalate templated microporous metal‒organic framework with electrochemical properties
• Authors of publication: Wang, Xiuli; Chang, Zhihan; Lin, Hongyan; Xu, Chuang; Luan, Jian; Liu, Guocheng; Tian, Aixiang
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 28.9058 ± 0.0004 Å
• b: 28.9058 ± 0.0004 Å
• c: 28.9058 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 24152.1 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 211
• Hermann-Mauguin space group symbol: I 4 3 2
• Hall space group symbol: I 4 2 3
• Residual factor for all reflections: 0.0235
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No