Information card for entry 4071298

Structure parameters

• Formula: C22 H25 Cl2 F3 N O3 V
• Calculated formula: C22 H25 Cl2 F3 N O3 V
• SMILES: [V]1(Cl)(Cl)([N](=Cc2c(O1)cccc2)c1ccc(cc1)C(F)(F)F)([O]1CCCC1)[O]1CCCC1
• Title of publication: Synthesis, Structural Characterization, and Ethylene Polymerization Behavior of the Vanadium(III) Complexes Bearing Salicylaldiminato Ligands
• Authors of publication: Wu, Ji-Qian; Pan, Li; Hu, Ning-Hai; Li, Yue-Sheng
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 15
• Pages of publication: 3840
• a: 7.6147 ± 0.0009 Å
• b: 12.0671 ± 0.0014 Å
• c: 13.7396 ± 0.0016 Å
• α: 67.631 ± 0.002°
• β: 85.279 ± 0.002°
• γ: 86.104 ± 0.002°
• Cell volume: 1162.6 ± 0.2 ų
• Cell temperature: 187 ± 2 K
• Ambient diffraction temperature: 187 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No