Information card for entry 7242409

Structure parameters

• Formula: C40 H78 Ce Cu2 N8 O62 P W11
• Calculated formula: C40 H32 Ce Cu2 N8 O51 P W11
• Title of publication: Two highly stable inorganic‒organic hybrid 3D frameworks based on Cu‒Ln incorporated polyoxometalates for selective dye removal and proton conduction
• Authors of publication: Zhang, Rong-Tao; Xiao, Hui-Ping; Li, Zhong; Wang, Min; Xie, Yu-Feng; Ye, Yi-Da; Li, Xin-Xiong; Zheng, Shou-Tian
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 16
• Pages of publication: 2973 - 2981
• a: 22.1444 ± 0.0018 Å
• b: 14.5741 ± 0.0011 Å
• c: 28.23 ± 0.002 Å
• α: 90°
• β: 102.549 ± 0.002°
• γ: 90°
• Cell volume: 8893.1 ± 1.2 ų
• Cell temperature: 175 ± 2 K
• Ambient diffraction temperature: 175 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1205
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No