Information card for entry 1575120

Structure parameters

• Formula: C39.5 H46 Co3 N2 O13.5
• Calculated formula: C39.5 H46 Co3 N2 O13.5
• 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: 11.5896 ± 0.0004 Å
• b: 13.272 ± 0.0005 Å
• c: 14.6041 ± 0.0004 Å
• α: 102.365 ± 0.003°
• β: 105.032 ± 0.003°
• γ: 93.29 ± 0.003°
• Cell volume: 2103.93 ± 0.13 ų
• Cell temperature: 100 ± 0.14 K
• Ambient diffraction temperature: 100 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0917
• Residual factor for significantly intense reflections: 0.0784
• Weighted residual factors for significantly intense reflections: 0.2135
• Weighted residual factors for all reflections included in the refinement: 0.2297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No