Information card for entry 4341240

Structure parameters

• Formula: C40 H80 O16 Ti4
• Calculated formula: C40 H80 O16 Ti4
• 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: 20.2877 ± 0.001 Å
• b: 23.6297 ± 0.0012 Å
• c: 11.5533 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5538.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0808
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.143
• Weighted residual factors for all reflections included in the refinement: 0.1684
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No