Information card for entry 4327790

Structure parameters

• Common name: C8H14[OSSO]Ti(OiPr)2
• Chemical name: C8H14[OSSO]Ti(OiPr)2
• Formula: C44 H72 O4 S2 Ti
• Calculated formula: C44 H72 O4 S2 Ti
• Title of publication: Titanium Complexes Supported by an [OSSO]-Type Bis(phenolato) Ligand Based on a trans-Cyclooctanediyl Platform: Synthesis, Structures, and 1-Hexene Polymerization
• Authors of publication: Norio Nakata; Tomoyuki Toda; Tsukasa Matsuo; Akihiko Ishii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 274 - 281
• a: 24.476 ± 0.005 Å
• b: 9.954 ± 0.002 Å
• c: 18.156 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4423.4 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1194
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No