Information card for entry 4341243

Structure parameters

• Formula: C70.5 H132 O24 Ti6
• Calculated formula: C70.5 H120 O24 Ti6
• Title of publication: The Structural Conversion of Multinuclear Titanium(IV) μ-Oxo-complexes
• Authors of publication: Radtke, Aleksandra; Piszczek, Piotr; Muzioł, Tadeusz; Wojtczak, Andrzej
• Journal of publication: Inorganic Chemistry
• Year of publication: 2014
• Pages of publication: 141006083028009
• a: 19.1601 ± 0.0005 Å
• b: 19.1601 ± 0.0005 Å
• c: 19.1601 ± 0.0005 Å
• α: 58.004 ± 0.002°
• β: 58.004 ± 0.002°
• γ: 58.004 ± 0.002°
• Cell volume: 4746 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :R
• Hall space group symbol: -P 3* 2n
• Residual factor for all reflections: 0.0724
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.1582
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No