Information card for entry 4105099

Structure parameters

• Common name: [(dmpm)CoCl(THF)][Li(THF)2]
• Chemical name: (mono-tetrahydrofuran)(1,9-dimesitly-5,5-dimethyldipyrromethanato)cobalt(II) chloride (bis-tetrahydrofuran)lithiate
• Formula: C41 H56 Cl Co Li N2 O3
• Calculated formula: C41 H56 Cl Co Li N2 O3
• Title of publication: Unusual Electronic Structure of First Row Transition Metal Complexes Featuring Redox-Active Dipyrromethane Ligands
• Authors of publication: Evan R. King; Theodore A. Betley
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 14374 - 14380
• a: 13.7199 ± 0.0007 Å
• b: 12.6669 ± 0.0005 Å
• c: 22.8413 ± 0.0012 Å
• α: 90°
• β: 103.487 ± 0.003°
• γ: 90°
• Cell volume: 3860.1 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1955
• Residual factor for significantly intense reflections: 0.0671
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1774
• Goodness-of-fit parameter for all reflections included in the refinement: 0.927
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No