Information card for entry 7713463

Structure parameters

• Formula: C44 H148 Fe6 Mn4 N28 Na4 O172 P4 W32
• Calculated formula: C44 H60 Fe5.9998 Mn4.0002 N28 Na4 O172 P4 W32
• Title of publication: MoO42–templated Ln20Ni21 heterometallic clusters with a large low-field magnetic entropy
• Authors of publication: Yu, Yating; Bai, Xu; Wang, Qin; Wang, Jilei; Xiang, Xinying; Zhou, Jiulin; Li, Siman; Xu, Yan
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 14.259 ± 0.004 Å
• b: 16.083 ± 0.005 Å
• c: 23.594 ± 0.007 Å
• α: 75.142 ± 0.004°
• β: 87.658 ± 0.004°
• γ: 68.882 ± 0.004°
• Cell volume: 4871 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1408
• Weighted residual factors for all reflections included in the refinement: 0.1558
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No