Information card for entry 7711090

Structure parameters

• Formula: C72 H98 Dy8 N6 O32
• Calculated formula: C72 H98 Dy8 N6 O32
• Title of publication: Self-assembly of octanuclear Ln(iii)-based clusters: their large magnetocaloric effects and highly efficient conversion of CO2
• Authors of publication: Wang, Wen-Min; Xin, Xiao-Yan; Qiao, Na; Wu, Zhi-Lei; Li, Ling; Zou, Ji-Yong
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 12.95 ± 0.0013 Å
• b: 14.4583 ± 0.0014 Å
• c: 14.5993 ± 0.0014 Å
• α: 101.562 ± 0.005°
• β: 103.649 ± 0.004°
• γ: 115.059 ± 0.004°
• Cell volume: 2261.9 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0915
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No