Information card for entry 4334032

Structure parameters

• Formula: C28 H32 Cl2 N3 V
• Calculated formula: C28 H32 Cl2 N3 V
• SMILES: [V]1(Cl)(Cl)(=NC23CC4CC(C2)CC(C3)C4)[n]2c3ccccc3ccc2CN1c1c(cccc1C)C
• Title of publication: Synthesis and Structural Analysis of (Imido)Vanadium(V) Complexes Containing Chelate (Anilido)Methyl-imine Ligands: Ligand Effect in Ethylene Dimerization
• Authors of publication: Kotohiro Nomura; Atsushi Igarashi; Shohei Katao; Wenjuan Zhang; Wen-Hua Sun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2607 - 2614
• a: 16.4655 ± 0.0003 Å
• b: 14.5364 ± 0.0002 Å
• c: 10.77817 ± 0.0001 Å
• α: 90°
• β: 99.4194°
• γ: 90°
• Cell volume: 2544.96 ± 0.06 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for all reflections included in the refinement: 0.0901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.137
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No