Information card for entry 7019768

Structure parameters

• Formula: C17 H32 Cl4 Li N3 O2 Si Zr
• Calculated formula: C17 H32 Cl4 Li N3 O2 Si Zr
• SMILES: [Zr]123(Cl)(Cl)([Cl][Li]([Cl]1)([O]1CCCC1)[O]1CCCC1)[n]1c(N2[Si]([N]3(C)C)(C)C)cccc1
• 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: 11.139 ± 0.003 Å
• b: 16.253 ± 0.004 Å
• c: 31.206 ± 0.008 Å
• α: 90°
• β: 98.317 ± 0.006°
• γ: 90°
• Cell volume: 5590 ± 2 ų
• Cell temperature: 238 ± 2 K
• Ambient diffraction temperature: 238 ± 2 K
• Number of distinct elements: 8
• 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: 0.2175
• Residual factor for significantly intense reflections: 0.0912
• Weighted residual factors for significantly intense reflections: 0.2584
• Weighted residual factors for all reflections included in the refinement: 0.3333
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No