Information card for entry 4083696

Structure parameters

• Chemical name: {(E)-2,6-dimethyl-N-(1-(6-(1-methyl-1H-benzo[d]imidazol-2-yl) pyridin-2-yl)ethylidene)benzenamine}dichloronickel
• Formula: C26 H29 Cl2 N5 Ni O
• Calculated formula: C26 H29 Cl2 N5 Ni O
• SMILES: [Ni]12(Cl)(Cl)[N](c3c(cccc3C)C)=C(c3[n]2c(c2n(c4c([n]12)cccc4)C)ccc3)C.O=CN(C)C
• Title of publication: Synthesis, Characterization and Ethylene Oligomerization Studies of Nickel Complexes Bearing 2-Benzimidazolylpyridine Derivatives
• Authors of publication: Hao, Peng; Zhang, Shu; Sun, Wen-Hua; Shi, Qisong; Adewuyi, Sherrif; Lu, Xiaoming; Li, Peizhou
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 9
• Pages of publication: 2439
• a: 8.6398 ± 0.0003 Å
• b: 12.7231 ± 0.0004 Å
• c: 12.8188 ± 0.0004 Å
• α: 70.687 ± 0.001°
• β: 80.101 ± 0.001°
• γ: 86.354 ± 0.001°
• Cell volume: 1309.98 ± 0.07 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: 0.0344
• Weighted residual factors for significantly intense reflections: 0.1004
• Weighted residual factors for all reflections included in the refinement: 0.1046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No