Information card for entry 4133366

Structure parameters

• Formula: C84 H1092 Ce8 Mo256 N42 Na6 O1270
• Calculated formula: C75 Ce8 Mo256 N36 O1152.25
• Title of publication: Stereoselective Assembly of Gigantic Chiral Molybdenum Blue Wheels Using Lanthanide Ions and Amino Acids.
• Authors of publication: Xuan, Weimin; Pow, Robert; Watfa, Nancy; Zheng, Qi; Surman, Andrew J.; Long, De-Liang; Cronin, Leroy
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 3
• Pages of publication: 1242 - 1250
• a: 31.5083 ± 0.0012 Å
• b: 31.9261 ± 0.0012 Å
• c: 41.4205 ± 0.0016 Å
• α: 111.747 ± 0.002°
• β: 91.181 ± 0.002°
• γ: 100.746 ± 0.002°
• Cell volume: 37838 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.1093
• Residual factor for significantly intense reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.1787
• Weighted residual factors for all reflections included in the refinement: 0.2157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No