Information card for entry 4120875

Structure parameters

• Formula: C87 H101 B Co2 F24 N6 O2 Si4
• Calculated formula: C87 H101 B Co2 F23.97 N6 O2 Si4
• Title of publication: A Dinuclear Cobalt Complex Featuring Unprecedented Anodic and Cathodic Redox Switches for Single-Molecule Magnet Activity
• Authors of publication: Skye Fortier; Jennifer J. Le Roy; Chun-Hsing Chen; Veacheslav Vieru; Muralee Murugesu; Liviu F. Chibotaru; Daniel J. Mindiola; Kenneth G. Caulton
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 14670 - 14678
• a: 15.0667 ± 0.0005 Å
• b: 15.2398 ± 0.0005 Å
• c: 23.1361 ± 0.0007 Å
• α: 77.074 ± 0.002°
• β: 89.669 ± 0.002°
• γ: 66.679 ± 0.002°
• Cell volume: 4734.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1341
• Goodness-of-fit parameter for all reflections included in the refinement: 0.888
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No