Information card for entry 4337760

Structure parameters

• Formula: C60 H74 Co0.85 O2
• Calculated formula: C60 H74 Co0.846 O2
• Title of publication: Synthesis, Structural, Spectroscopic, and Magnetic Characterization of Two-Coordinate Cobalt(II) Aryloxides with Bent or Linear Coordination.
• Authors of publication: Bryan, Aimee M.; Long, Gary J.; Grandjean, Fernande; Power, Philip P.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 2692 - 2698
• a: 10.7365 ± 0.0008 Å
• b: 20.2062 ± 0.0015 Å
• c: 11.1732 ± 0.0009 Å
• α: 90°
• β: 90.411 ± 0.0011°
• γ: 90°
• Cell volume: 2423.9 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• 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: 0.069
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1285
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No