Information card for entry 4332218

Structure parameters

• Formula: C22 H20 Cu F12 N4 O6
• Calculated formula: C22 H20 Cu F12 N4 O6
• Title of publication: 2D and 3D Cu(hfac)2Complexes with Nitronyl Nitroxide Biradicals
• Authors of publication: Tretyakov, Eugene; Fokin, Sergei; Romanenko, Galina; Ikorskii, Vladimir; Vasilevsky, Sergei; Ovcharenko, Victor
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 9
• Pages of publication: 3671 - 3678
• a: 15.0952 ± 0.0012 Å
• b: 15.0952 ± 0.0012 Å
• c: 24.85 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5662.4 ± 0.9 ų
• Cell temperature: 240 ± 2 K
• Ambient diffraction temperature: 240 ± 2 K
• Number of distinct elements: 6
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No