Information card for entry 7019769

Structure parameters

• Formula: C22 H40 Cl2 Fe2 N6 O Si2
• Calculated formula: C22 H40 Cl2 Fe2 N6 O Si2
• SMILES: [Fe]123(Cl)[n]4c(N5[Fe](Cl)([N]([Si]5(C)C)(C)C)([n]5c(N1[Si]([N]2(C)C)(C)C)cccc5)[O]13CCCC1)cccc4
• 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: 13.417 ± 0.002 Å
• b: 16.024 ± 0.002 Å
• c: 14.649 ± 0.002 Å
• α: 90°
• β: 92.06 ± 0.003°
• γ: 90°
• Cell volume: 3147.4 ± 0.7 ų
• Cell temperature: 238 ± 2 K
• Ambient diffraction temperature: 238 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0819
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1599
• Weighted residual factors for all reflections included in the refinement: 0.172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No