Information card for entry 4515851

Structure parameters

• Common name: Alon091216
• Formula: C26 H28 B2 Co F8 N8 O
• Calculated formula: C26 H28 B2 Co F8 N8 O
• 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: 10.1224 ± 0.0007 Å
• b: 11.5342 ± 0.0008 Å
• c: 12.3686 ± 0.0008 Å
• α: 84.499 ± 0.005°
• β: 89.722 ± 0.005°
• γ: 77.529 ± 0.005°
• Cell volume: 1403.33 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0858
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.1861
• Weighted residual factors for all reflections included in the refinement: 0.1986
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No