Information card for entry 4322975

Structure parameters

• Formula: C22 H32 Cl O Ti
• Calculated formula: C22 H32 Cl O Ti
• Title of publication: Monocyclopentadienyl-Titanium Aryloxide Sulfide 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: 4726 - 4731
• a: 9.866 ± 0.001 Å
• b: 10.106 ± 0.001 Å
• c: 12.227 ± 0.002 Å
• α: 81.995 ± 0.002°
• β: 69.531 ± 0.002°
• γ: 71.627 ± 0.002°
• Cell volume: 1083.3 ± 0.2 ų
• Cell temperature: 273.2 K
• Ambient diffraction temperature: 273.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.068
• Goodness-of-fit parameter for significantly intense reflections: 0.65
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No