Information card for entry 4341478

Structure parameters

• Formula: C70 H69 Fe Mn N8 O3.5 P2
• Calculated formula: C70 H69 Fe Mn N8 O3.5 P2
• Title of publication: Magnetic Relaxation of 1D Coordination Polymers (X)2[Mn(acacen)Fe(CN)6], X = Ph4P(+), Et4N(+).
• Authors of publication: Rams, Michał; Peresypkina, Eugenia V.; Mironov, Vladimir S.; Wernsdorfer, Wolfgang; Vostrikova, Kira E.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 10291 - 10300
• a: 13.3007 ± 0.0004 Å
• b: 15.2241 ± 0.0004 Å
• c: 18.5888 ± 0.0005 Å
• α: 94.085 ± 0.001°
• β: 110.098 ± 0.001°
• γ: 114.038 ± 0.001°
• Cell volume: 3128.88 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0698
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.12
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No