Information card for entry 7114309

Structure parameters

• Common name: [Mn(hfac)2(PyrimPhNIT)]2
• Formula: C48 H36 F24 Mn2 N6 O10
• Calculated formula: C48 H27 F24 Mn2 N6 O10
• Title of publication: 1∶1 Complexes of 5-(4-[N-tert-butyl-N-aminoxyl]phenyl)pyrimidine with manganese(ii) and copper(ii) hexafluoroacetonylacetonateElectronic supplementary information (ESI) available: Spectroscopic data and crystallography for 1. Fig. S1: ESR spectrum of 1. See http://www.rsc.org/suppdata/cc/b1/b111295n/
• Authors of publication: Field, Lora M.; Lahti, Paul M.; Palacio, Fernando
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 6
• Pages of publication: 636
• a: 9.8889 ± 0.0002 Å
• b: 28.9225 ± 0.0006 Å
• c: 21.2731 ± 0.0004 Å
• α: 90°
• β: 78.3397 ± 0.0016°
• γ: 90°
• Cell volume: 5958.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1678
• Residual factor for significantly intense reflections: 0.1341
• Weighted residual factors for significantly intense reflections: 0.3377
• Weighted residual factors for all reflections included in the refinement: 0.3584
• Goodness-of-fit parameter for all reflections included in the refinement: 2.537
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No