Information card for entry 4308205

Structure parameters

• Common name: (1) [Sc(mu-ONep)2(ONep)]4
• Formula: C60 H132 O12 Sc4
• Calculated formula: C60 H132 O12 Sc4
• SMILES: C(O[Sc]123[O](CC(C)(C)C)[Sc]4([O](CC(C)(C)C)[Sc]5([O](CC(C)(C)C)[Sc]([O]1CC(C)(C)C)([O]2CC(C)(C)C)([O]5CC(C)(C)C)OCC(C)(C)C)([O]4CC(C)(C)C)OCC(C)(C)C)([O]3CC(C)(C)C)OCC(C)(C)C)C(C)(C)C
• Title of publication: Isostructural neo-Pentoxide Derivatives of Group 3 and the Lanthanide Series Metals for the Production of Ln2O3 Nanoparticles
• Authors of publication: Timothy J. Boyle; Leigh Anna M. Ottley; Sherrika D. Daniel-Taylor; Louis J. Tribby; Scott D. Bunge; Alison L. Costello; Todd M. Alam; John C. Gordon; T. Mark MCleskey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 3705 - 3713
• a: 20.17 ± 0.002 Å
• b: 20.17 ± 0.002 Å
• c: 11.844 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4818.5 ± 1.4 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 4
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0505
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1298
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No