Information card for entry 7064026

Structure parameters

• Formula: C100 H102 Co2 O14
• Calculated formula: C100 H102 Co2 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: 14.372 ± 0.005 Å
• b: 25.215 ± 0.009 Å
• c: 23.014 ± 0.009 Å
• α: 90°
• β: 92.748 ± 0.007°
• γ: 90°
• Cell volume: 8330 ± 5 ų
• Cell temperature: 100.02 K
• Ambient diffraction temperature: 100.02 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0639
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No