Information card for entry 4314935

Structure parameters

• Common name: [(tpe)Co(py)][Li(thf)4]
• Formula: C66 H87 Co Li N4 O5
• Calculated formula: C66 H87 Co Li N4 O5
• Title of publication: Ligand-Centered Redox Activity: Redox Properties of 3d Transition Metal Ions Ligated by the Weak-Field Tris(pyrrolyl)ethane Trianion
• Authors of publication: Graham T. Sazama; Theodore A. Betley
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2512 - 2524
• a: 12.0728 ± 0.0007 Å
• b: 13.1443 ± 0.0007 Å
• c: 21.9752 ± 0.0012 Å
• α: 77.548 ± 0.001°
• β: 88.973 ± 0.001°
• γ: 63.409 ± 0.001°
• Cell volume: 3032.6 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0496
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1253
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No