Information card for entry 7064027

Structure parameters

• Formula: C86 H86 Co O14
• Calculated formula: C86 H86 Co O14
• Title of publication: Dicobalt tetracarboxylate complexes with labile axial ligands
• Authors of publication: Pankratz, Trey C.; Harris, Caleb F.; Hyland, Ethan E.; Sailer, Joshua K.; Wheaton, Amelia M.; Davies, Huw M. L.; Berry, John F.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2025
• Journal volume: 49
• Journal issue: 42
• Pages of publication: 18292 - 18302
• a: 12.13 ± 0.003 Å
• b: 12.137 ± 0.003 Å
• c: 13.833 ± 0.004 Å
• α: 109.773 ± 0.011°
• β: 98.611 ± 0.01°
• γ: 104.368 ± 0.013°
• Cell volume: 1794.5 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0351
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.0889
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No