Information card for entry 7709025

Structure parameters

• Formula: C72 H64 N7 O35 Tm4
• Calculated formula: C57 H25 N2 O26 Tm4
• Title of publication: Investigation on the Catalytic Behavior of one Novel Thulium-Organic Framework with Planar Tetranuclear {Tm4} Cluster as Active Center for Chemical CO2 Fixation
• Authors of publication: Chen, Hongtai; Zhang, Zhengguo; Hongxiao, Lv; Liu, Shurong; Zhang, Xiutang
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 22.12 ± 0.004 Å
• b: 22.12 ± 0.004 Å
• c: 38.202 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 16188 ± 5 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 193
• Hermann-Mauguin space group symbol: P 63/m c m
• Hall space group symbol: -P 6c 2
• Residual factor for all reflections: 0.0497
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0969
• Weighted residual factors for all reflections included in the refinement: 0.1044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No