Information card for entry 4069232

Structure parameters

• Formula: C10 H10 Cl4 O Ti2
• Calculated formula: C10 H10 Cl4 O Ti2
• SMILES: [cH]12[cH]3[Ti]452([cH]1[cH]4[cH]35)(O[Ti]1234([cH]5[cH]4[cH]3[cH]2[cH]15)(Cl)Cl)(Cl)Cl
• Title of publication: Synthesis, Structures, and Polymerization Catalytic Properties of Doubly Bridged Bis(cyclopentadienyl) Dinuclear (μ-Oxo)titanium Complexes
• Authors of publication: Luo, Shuang; Shen, Bo; Li, Bin; Song, Haibin; Xu, Shansheng; Wang, Baiquan
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 10
• Pages of publication: 3109
• a: 7.567 ± 0.004 Å
• b: 9.918 ± 0.005 Å
• c: 9.921 ± 0.005 Å
• α: 90°
• β: 91.721 ± 0.009°
• γ: 90°
• Cell volume: 744.2 ± 0.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0666
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No