Information card for entry 4317135

Structure parameters

• Common name: HfONep CHCl3
• Formula: C45 H99 Hf2 O9
• Calculated formula: C45 H99 Hf2 O9
• SMILES: [Hf]12([O](CC(C)(C)C)[Hf]([O]1CC(C)(C)C)([O]2CC(C)(C)C)(OCC(C)(C)C)(OCC(C)(C)C)OCC(C)(C)C)(OCC(C)(C)C)(OCC(C)(C)C)OCC(C)(C)C
• Title of publication: Series of Comparable Dinuclear Group 4 Neo-pentoxide Precursors for Production of pH Dependent Group 4 Nanoceramic Morphologies
• Authors of publication: Timothy J. Boyle; Leigh Anna M. Ottley; Sarah M. Hoppe; Charles F. Campana
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 10798 - 10808
• a: 10.7521 ± 0.0017 Å
• b: 18.481 ± 0.003 Å
• c: 14.477 ± 0.002 Å
• α: 90°
• β: 105.692 ± 0.002°
• γ: 90°
• Cell volume: 2769.5 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No