Information card for entry 4303632

Structure parameters

• Common name: (Fc2Bob)Ti(OC6H4-2-OH)2
• Chemical name: (2,2'-Biphenylbis(4-ferrocenyl-2,4-butanedionato))bis(2- hydroxyphenoxy)titanium(IV)
• Formula: C52 H42 Fe2 O8 Ti
• Calculated formula: C52 H42 Fe2 O8 Ti
• Title of publication: Intermetallic Communication in Titanium(IV) Ferrocenyldiketonates
• Authors of publication: Lea T. Dulatas; Seth N. Brown; Edema Ojomo; Bruce C. Noll; Matthew J. Cavo; Paul B. Holt; Matthew M. Wopperer
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 10789 - 10799
• a: 13.6137 ± 0.0004 Å
• b: 18.063 ± 0.0005 Å
• c: 18.016 ± 0.0005 Å
• α: 90°
• β: 109.75 ± 0.002°
• γ: 90°
• Cell volume: 4169.6 ± 0.2 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No