Information card for entry 7713423

Structure parameters

• Formula: C180 H154.5 B2 Dy2 N17.5 O5
• Calculated formula: C168 H134 B2 Dy2 N12 O4
• Title of publication: Peroxido-bridged chiral double-decker dysprosium macrocycles
• Authors of publication: Zhao, Chen; Wang, Tingting; Liu, Xiaodong; Zhu, Zhenhua; Ying, Xu; Li, Xiao-Lei; Tang, Jinkui
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 29.7543 ± 0.0012 Å
• b: 17.3502 ± 0.0007 Å
• c: 62.722 ± 0.002 Å
• α: 90°
• β: 103.169 ± 0.001°
• γ: 90°
• Cell volume: 31528 ± 2 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.2285
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.2485
• Weighted residual factors for all reflections included in the refinement: 0.3448
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No