Information card for entry 7230623

Structure parameters

• Formula: C25 H24 F12 Mn N3 O5
• Calculated formula: C25 H24 F12 Mn N3 O5
• Title of publication: Synthesis, crystal structures and magnetic properties of six coordination compounds constructed with pyridine iminomethyl‒TEMPO radicals and [M(hfac)2] (M = CuII and MnII)
• Authors of publication: Gao, Yan-Li; Nishihara, Sadafumi; Inoue, Katsuya
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 21
• Pages of publication: 2961
• a: 18.4213 ± 0.0008 Å
• b: 18.1732 ± 0.0008 Å
• c: 19.0497 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6377.3 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1044
• Residual factor for significantly intense reflections: 0.074
• Weighted residual factors for significantly intense reflections: 0.2124
• Weighted residual factors for all reflections included in the refinement: 0.2461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No