Information card for entry 1571932

Structure parameters

• Formula: C45.1 H106.75 Mo10 N5 O36.78 Zr
• Calculated formula: C45.104 H106.76 Mo10 N5 O36.776 Zr
• Title of publication: Leveraging a reduced polyoxomolybdate-alkoxide cluster for the formation of a stable U(v) sandwich complex.
• Authors of publication: Shiels, Dominic; Brennessel, William W.; Crawley, Matthew R.; Matson, Ellen M.
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 28
• Pages of publication: 11072 - 11083
• a: 21.4037 ± 0.0002 Å
• b: 15.094 ± 0.0002 Å
• c: 24.2093 ± 0.0003 Å
• α: 90°
• β: 92.655 ± 0.001°
• γ: 90°
• Cell volume: 7812.84 ± 0.16 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.0891
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No