Information card for entry 4515850

Structure parameters

• Formula: C25 H24 B2 Co F8 N10
• Calculated formula: C25 H24 B2 Co F8 N10
• Title of publication: Pendant Hydrogen-Bond Donors in Cobalt Catalysts Independently Enhance CO₂ Reduction.
• Authors of publication: Chapovetsky, Alon; Welborn, Matthew; Luna, John M.; Haiges, Ralf; Miller, 3rd, Thomas F; Marinescu, Smaranda C.
• Journal of publication: ACS central science
• Year of publication: 2018
• Journal volume: 4
• Journal issue: 3
• Pages of publication: 397 - 404
• a: 12.026 ± 0.006 Å
• b: 12.302 ± 0.006 Å
• c: 14.145 ± 0.007 Å
• α: 72.461 ± 0.008°
• β: 79.742 ± 0.008°
• γ: 64.354 ± 0.008°
• Cell volume: 1796 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1264
• Residual factor for significantly intense reflections: 0.0868
• Weighted residual factors for significantly intense reflections: 0.2252
• Weighted residual factors for all reflections included in the refinement: 0.2609
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No