Information card for entry 7051295

Structure parameters

• Formula: C28 H29 F12 Mn N2 O7
• Calculated formula: C28 H29 F12 Mn N2 O7
• Title of publication: Synthesis and magnetic properties of a new complex made up of Mn(hfac)2 and a radical with a triplet ground state
• Authors of publication: Kumagai, Hitoshi; Hosokoshi, Yuko; Markosyan, Ashot S.; Inoue, Katsuya
• Journal of publication: New Journal of Chemistry
• Year of publication: 2000
• Journal volume: 24
• Journal issue: 7
• Pages of publication: 537
• a: 14.081 ± 0.001 Å
• b: 15.94 ± 0.0011 Å
• c: 16.0751 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3608.1 ± 0.4 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1584
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.1692
• Weighted residual factors for all reflections included in the refinement: 0.21
• Goodness-of-fit parameter for all reflections included in the refinement: 0.859
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No