Information card for entry 1569512

Structure parameters

• Formula: C27 H37 F24 K2 Mn O8
• Calculated formula: C27 H37.0012 F24 K2 Mn O8
• Title of publication: HAA by the first {Mn(iii)OH} complex with all O-donor ligands.
• Authors of publication: Moore, Shawn M.; Sun, Chen; Steele, Jennifer L.; Laaker, Ellen M.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 30
• Pages of publication: 8187 - 8195
• a: 11.3681 ± 0.0005 Å
• b: 11.9761 ± 0.0006 Å
• c: 16.7124 ± 0.0008 Å
• α: 78.016 ± 0.002°
• β: 70.97 ± 0.002°
• γ: 84.166 ± 0.002°
• Cell volume: 2102.67 ± 0.17 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1874
• Weighted residual factors for all reflections included in the refinement: 0.1904
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No