Information card for entry 4327792

Structure parameters

• Common name: {C8H14[OSSO]Ti(NEt2)2}2
• Chemical name: {C8H14[OSSO]Ti(NEt2)2}2
• Formula: C92 H156 N4 O4 S4 Ti2
• Calculated formula: C92 H156 N4 O4 S4 Ti2
• 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: 9.67 ± 0.004 Å
• b: 14.572 ± 0.007 Å
• c: 17.708 ± 0.009 Å
• α: 108.357 ± 0.004°
• β: 102.91 ± 0.009°
• γ: 93.858 ± 0.005°
• Cell volume: 2282.7 ± 1.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1605
• Residual factor for significantly intense reflections: 0.0728
• Weighted residual factors for significantly intense reflections: 0.1126
• Weighted residual factors for all reflections included in the refinement: 0.1378
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No