Information card for entry 7016161

Structure parameters

• Formula: C26 H40 N4 Si Ti
• Calculated formula: C26 H40 N4 Si Ti
• SMILES: C1(c2ccccc2)N([Ti]23([N]=1[Si](C)([N]2=C(c1ccccc1)N3C(C)(C)C)C)(C)C)C(C)(C)C
• Title of publication: Mononuclear titanium compounds based on the silyl-linked bis(amidinate) ligand: synthesis, characterization and ethylene polymerization.
• Authors of publication: Bai, Sheng-Di; Guan, Fei; Hu, Min; Yuan, Shi-Fang; Guo, Jian-Ping; Liu, Dian-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 30
• Pages of publication: 7686 - 7688
• a: 22.957 ± 0.015 Å
• b: 26.99 ± 0.018 Å
• c: 9.165 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5679 ± 6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0866
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1674
• Weighted residual factors for all reflections included in the refinement: 0.1818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No