Information card for entry 1556281

Structure parameters

• Formula: C24 H34 N O4 V
• Calculated formula: C24 H34 N O4 V
• SMILES: C(CC)[N]12Cc3c(c(cc(c3)C)C)O[V]2(OC(C)C)(Oc2c(cc(cc2C1)C)C)=O
• Title of publication: Amine influence in vanadium-based ethylene polymerisation pro-catalysts bearing bis(phenolate) ligands with ‘pendant’ arms
• Authors of publication: Lorber, Christian; Despagnet-Ayoub, Emmanuelle; Vendier, Laure; Arbaoui, Abdessamad; Redshaw, Carl
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2011
• Journal volume: 1
• Journal issue: 3
• Pages of publication: 489
• a: 8.4832 ± 0.0012 Å
• b: 11.5025 ± 0.0016 Å
• c: 24.14 ± 0.003 Å
• α: 90°
• β: 94.873 ± 0.012°
• γ: 90°
• Cell volume: 2347 ± 0.6 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 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 all reflections: 0.1833
• Residual factor for significantly intense reflections: 0.0681
• Weighted residual factors for significantly intense reflections: 0.1089
• Weighted residual factors for all reflections included in the refinement: 0.1377
• Goodness-of-fit parameter for all reflections included in the refinement: 0.959
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No