Information card for entry 4083637

Structure parameters

• Chemical name: [2-carboethoxy-6-(1-methyl-2-benzoimidazolyl)pyridine]dichlorocobalt
• Formula: C16 H15 Cl2 Co N3 O2
• Calculated formula: C16 H15 Cl2 Co N3 O2
• SMILES: [Co]1(Cl)(Cl)[n]2c(c3n(c4c([n]13)cccc4)C)cccc2C(=O)OCC
• Title of publication: Iron(II) and Cobalt(II) 2-(Benzimidazolyl)-6-(1-(arylimino)ethyl)pyridyl Complexes as Catalysts for Ethylene Oligomerization and Polymerization
• Authors of publication: Sun, Wen-Hua; Hao, Peng; Zhang, Shu; Shi, Qisong; Zuo, Weiwei; Tang, Xiubo; Lu, Xiaoming
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 10
• Pages of publication: 2720
• a: 7.7749 ± 0.0003 Å
• b: 8.3615 ± 0.0002 Å
• c: 13.3453 ± 0.0004 Å
• α: 92.052 ± 0.002°
• β: 93.674 ± 0.002°
• γ: 99.584 ± 0.002°
• Cell volume: 852.76 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No