Information card for entry 7025995

Structure parameters

• Chemical name: bis(2,6-diisopropylphenyl)imidotungsten dichloride dimethoxyethane
• Formula: C28 H44 Cl2 N2 O2 W
• Calculated formula: C28 H44 Cl2 N2 O2 W
• SMILES: [W]1(Cl)(Cl)([O](C)CC[O]1C)(=Nc1c(cccc1C(C)C)C(C)C)=Nc1c(cccc1C(C)C)C(C)C
• Title of publication: Exploring the reactivity of tungsten bis(imido) dimethyl complexes with methyl aluminium reagents: implications for ethylene dimerization.
• Authors of publication: Wright, William R. H.; Batsanov, Andrei S.; Howard, Judith A. K.; Tooze, Robert P.; Hanton, Martin J.; Dyer, Philip W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 30
• Pages of publication: 7038 - 7045
• a: 10.5913 ± 0.0014 Å
• b: 16.009 ± 0.002 Å
• c: 18.714 ± 0.003 Å
• α: 80.84 ± 0.03°
• β: 87.75 ± 0.03°
• γ: 76.79 ± 0.02°
• Cell volume: 3049.7 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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 all reflections: 0.0266
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0432
• Weighted residual factors for all reflections included in the refinement: 0.046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No