Information card for entry 7017964

Structure parameters

• Formula: C62 H64 Cl4 N4 Ni2 O2
• Calculated formula: C62 H64 Cl4 N4 Ni2 O2
• SMILES: c1ccc2c3C(CCC2)=[N]([Ni]2([n]13)([Cl][Ni]1([n]3cccc4c3C(CCC4)=[N]1c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C)([OH]C)(Cl)[Cl]2)([OH]C)Cl)c1c(cc(cc1C(c1ccccc1)c1ccccc1)C)C
• Title of publication: N-(5,6,7-Trihydroquinolin-8-ylidene)-2-benzhydrylbenzenaminonickel halide complexes: synthesis, characterization and catalytic behavior towards ethylene polymerization.
• Authors of publication: Hou, Xiaohua; Cai, Zhengguo; Chen, Xia; Wang, Lin; Redshaw, Carl; Sun, Wen-Hua
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 5
• Pages of publication: 1617 - 1623
• a: 14.895 ± 0.003 Å
• b: 15.229 ± 0.003 Å
• c: 15.55 ± 0.003 Å
• α: 90°
• β: 103.64 ± 0.03°
• γ: 90°
• Cell volume: 3427.8 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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 significantly intense reflections: 0.0641
• Weighted residual factors for significantly intense reflections: 0.1859
• Weighted residual factors for all reflections included in the refinement: 0.1924
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No