Information card for entry 7704741

Structure parameters

• Formula: C100 H126 Gd N11 O15 Zn3
• Calculated formula: C100 H126 Gd N11 O15 Zn3
• Title of publication: Self-assembly of tetranuclear 3d-4f helicates as highly efficient catalysts for CO₂ cycloaddition reactions under mild conditions.
• Authors of publication: Yang, Huan; Gao, Guoshu; Chen, Wanmin; Wang, Li; Liu, Weisheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 29
• Pages of publication: 10270 - 10277
• a: 15.2301 ± 0.0004 Å
• b: 19.7361 ± 0.0005 Å
• c: 19.7667 ± 0.0006 Å
• α: 70.414 ± 0.002°
• β: 87.94 ± 0.002°
• γ: 85.25 ± 0.002°
• Cell volume: 5578.3 ± 0.3 ų
• Cell temperature: 295.42 ± 0.1 K
• Ambient diffraction temperature: 295.42 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0852
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1174
• Weighted residual factors for all reflections included in the refinement: 0.1387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No