Information card for entry 4322981

Structure parameters

• Formula: C41 H56 N O2 Ti
• Calculated formula: C41 H57 N O2 Ti
• Title of publication: Cyclopentadienyl-Bis-Aryloxide Titanium Complexes
• Authors of publication: Andrea V. Firth; Douglas W. Stephan
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 4732 - 4734
• a: 15.3195 ± 0.0002 Å
• b: 14.2922 ± 0.0002 Å
• c: 18.54 ± 0.0004 Å
• α: 90°
• β: 107.61 ± 0.007°
• γ: 90°
• Cell volume: 3869.09 ± 0.19 ų
• Cell temperature: 273.2 K
• Ambient diffraction temperature: 273.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.067
• Goodness-of-fit parameter for significantly intense reflections: 2.08
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No