Information card for entry 7033878

Structure parameters

• Formula: C40 H8 F48 O20 Ti4
• Calculated formula: C40 H8 F48 O20 Ti4
• Title of publication: Observed hydrolysis of fluorine substituted bis(β-diketonato)-dichlorotitanium(iv) complexes.
• Authors of publication: Kuhn, A.; Conradie, J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 11
• Pages of publication: 5106 - 5113
• a: 13.7394 ± 0.0004 Å
• b: 16.4156 ± 0.0004 Å
• c: 29.3154 ± 0.0007 Å
• α: 90°
• β: 107.707 ± 0.001°
• γ: 90°
• Cell volume: 6298.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0511
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0908
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No