Information card for entry 7718590

Structure parameters

• Common name: [Dy(HMPA)4(SCN)2](PF6), DongXY-25Mar26a
• Formula: C26 H72 Dy F6 N14 O4 P5 S2
• Calculated formula: C26 H72 Dy F6 N14 O4 P5 S2
• Title of publication: Synergistic construction of highly symmetrical lanthanide single-ion magnets using neutral phosphoryl and anionic thiocyanate ligands.
• Authors of publication: Liu, Bei; Dong, Xiao-Yan; Gong, Hui-Wen; Sun, Zheng; Sun, Rong; Zhu, Wen-Hua; Zhang, Lei; Sun, Hao-Ling; Zhao, Man-Yun; Huang, Ning-Ning; Bian, Qing-Yan; Gao, Song
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 22
• Pages of publication: 9039 - 9048
• a: 26.6565 ± 0.0013 Å
• b: 24.4382 ± 0.0011 Å
• c: 16.725 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10895.3 ± 0.9 ų
• Cell temperature: 150.15 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 8
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1272
• Residual factor for significantly intense reflections: 0.0929
• Weighted residual factors for significantly intense reflections: 0.2112
• Weighted residual factors for all reflections included in the refinement: 0.2295
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No