Information card for entry 7026958

Structure parameters

• Formula: C181 H160 Ce4 Cl4 N24 O39
• Calculated formula: C181 H104 Ce4 Cl4.021 N24 O38.99
• Title of publication: A symmetry-controlled and face-driven approach for the assembly of cerium-based molecular polyhedra.
• Authors of publication: Liu, Yang; Lin, Zhihua; He, Cheng; Zhao, Liang; Duan, Chunying
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 46
• Pages of publication: 11122 - 11125
• a: 18.496 ± 0.013 Å
• b: 18.588 ± 0.013 Å
• c: 30.52 ± 0.02 Å
• α: 104.616 ± 0.013°
• β: 102.949 ± 0.013°
• γ: 91.295 ± 0.014°
• Cell volume: 9860 ± 12 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 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: 0.4078
• Residual factor for significantly intense reflections: 0.1486
• Weighted residual factors for significantly intense reflections: 0.2761
• Weighted residual factors for all reflections included in the refinement: 0.3337
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No