Information card for entry 7019767

Structure parameters

• Formula: C22 H32 Cl4 N4 O3 Ti2
• Calculated formula: C22 H32 Cl4 N4 O3 Ti2
• SMILES: [Ti]123(N(c4[n]3cccc4)[Ti](Cl)(Cl)(N2c2[n]1cccc2)([O]1CCCC1)[O]1CCCC1)(Cl)(Cl)[O]1CCCC1
• Title of publication: Metal (Mg, Fe, Co, Zr and Ti) complexes derived from aminosilyl substituted aminopyridinato ligand: synthesis, structures and ethylene polymerization behaviors of the group 4 complexes.
• Authors of publication: Duan, Xin-E; Yuan, Shi-Fang; Tong, Hong-Bo; Bai, Sheng-Di; Wei, Xue-Hong; Liu, Dian-Sheng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 31
• Pages of publication: 9460 - 9467
• a: 15.206 ± 0.006 Å
• b: 11.636 ± 0.004 Å
• c: 15.911 ± 0.006 Å
• α: 90°
• β: 93.202 ± 0.005°
• γ: 90°
• Cell volume: 2810.8 ± 1.8 ų
• Cell temperature: 238 ± 2 K
• Ambient diffraction temperature: 238 ± 2 K
• Number of distinct elements: 6
• 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: 0.0516
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.1009
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No