Information card for entry 7105340

Structure parameters

• Common name: Bis(ethyltetramethylcyclopentadienyl)(hydroxo)- (trifluoroethenyl)titanium(IV)
• Chemical name: Bis(ethyltetramethylcyclopentadienyl)(hydroxo)- (trifluoroethenyl)titanium(IV)
• Formula: C24 H35 F3 O Ti
• Calculated formula: C24 H34 F3 O Ti
• Title of publication: Synthesis and reactions of hydroxobis(eta5-pentamethylcyclopenta-dienyl)(trifluoroethenyl)titanium(IV).
• Authors of publication: Kickbusch, Rainer; Lentz, Dieter
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 12
• Pages of publication: 2118 - 2120
• a: 14.138 ± 0.005 Å
• b: 10.007 ± 0.004 Å
• c: 16.696 ± 0.006 Å
• α: 90°
• β: 108.655 ± 0.007°
• γ: 90°
• Cell volume: 2238 ± 1.4 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 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: 0.092
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1404
• Weighted residual factors for all reflections included in the refinement: 0.155
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No