Information card for entry 4102213

Structure parameters

• Formula: C24 H30 Cl2 N3 V
• Calculated formula: C24 H30 Cl2 N3 V
• SMILES: [V]1(Cl)(Cl)([n]2c(cccc2)CN1c1c(cccc1C)C)=NC12CC3CC(CC(C3)C2)C1
• Title of publication: Highly Efficient Dimerization of Ethylene by (Imido)vanadium Complexes Containing (2-Anilidomethyl)pyridine Ligands: Notable Ligand Effect toward Activity and Selectivity
• Authors of publication: Shu Zhang; Kotohiro Nomura
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 4960 - 4965
• a: 12.0709 ± 0.0004 Å
• b: 12.539 ± 0.0005 Å
• c: 15.2621 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2310.03 ± 0.14 ų
• Cell temperature: 113.1 K
• Ambient diffraction temperature: 113.1 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0169
• Weighted residual factors for all reflections included in the refinement: 0.0519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No