Information card for entry 4310530

Structure parameters

• Formula: C22.25 H19 Cu F12 N4 O6
• Calculated formula: C24 H19 Cu F12 N4 O6
• Title of publication: Problem of a Wide Variety of Products in the Cu(hfac)2-Nitroxide System
• Authors of publication: Sergei Fokin; Victor Ovcharenko; Galina Romanenko; Vladimir Ikorskii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 969 - 977
• a: 22.715 ± 0.003 Å
• b: 22.715 ± 0.003 Å
• c: 64.199 ± 0.013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 28687 ± 8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.2361
• Residual factor for significantly intense reflections: 0.0773
• Weighted residual factors for significantly intense reflections: 0.1763
• Weighted residual factors for all reflections included in the refinement: 0.248
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No