Information card for entry 1512484

Structure parameters

• Formula: C32 H47 Co F6 N7 O3 P
• Calculated formula: C32 H47 Co F6 N7 O3 P
• Title of publication: The effects of tripodal ligands on charge distribution in cobalt(III)-catecholate and cobalt(II)-semiquinonate compounds
• Authors of publication: Fan Yu; Bao Li
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 392
• Pages of publication: 199 - 203
• a: 9.6337 ± 0.0003 Å
• b: 14.4703 ± 0.0005 Å
• c: 14.8189 ± 0.0006 Å
• α: 108.929 ± 0.004°
• β: 95.084 ± 0.003°
• γ: 101.405 ± 0.003°
• Cell volume: 1889.32 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0591
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1345
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No