Information card for entry 7711678

Structure parameters

• Formula: C60 H78 Fe6 Mo24 N10 Na4 O136 P17
• Calculated formula: C24 H28 Fe6 Mo24 N4 Na4 O132 P17
• Title of publication: Two Three-dimensional Fe(II) Frameworks Based on {P4Mo6} Tetrameric Clusters Exhibiting Efficient Visible-light Photocatalytic Properties for the Degradation of Cr(VI) and Methylene Blue
• Authors of publication: Guo, Hui-li; Xing, Xiao-Xiao; Mao, Shao-Xu; Feng, Tong; Fan, Yanhua; Qin, Zhijie; Pang, Jingyu; Bai, Yan; Dang, Dong-Bin
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 26.6013 ± 0.0007 Å
• b: 26.6013 ± 0.0007 Å
• c: 43.3793 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 30696.5 ± 1.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.01 K
• Number of distinct elements: 8
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d :2
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.0908
• Residual factor for significantly intense reflections: 0.0564
• Weighted residual factors for significantly intense reflections: 0.1107
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0486
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No