Information card for entry 1575121

Structure parameters

• Formula: C68 H78 B2 Co4 F8 N4 O16
• Calculated formula: C68 H78 B2 Co4 F8 N4 O16
• Title of publication: Anion controlled selectivity in oxygen reduction catalysed by a dinuclear cobalt N,O-Schiff base complex.
• Authors of publication: James, Charles A.; Swindells, Jessica E.; Ellis, Harry; Arjariya, Richa; Jarvis, Samuel P.; Brookfield, Adam; Fielden, John
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 70
• Pages of publication: 13201 - 13204
• a: 12.7253 ± 0.0002 Å
• b: 13.2722 ± 0.0002 Å
• c: 22.5229 ± 0.0004 Å
• α: 97.208 ± 0.001°
• β: 97.696 ± 0.002°
• γ: 108.398 ± 0.002°
• Cell volume: 3519.64 ± 0.11 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0681
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1376
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No