Information card for entry 7018431

Structure parameters

• Formula: C66 H92 Fe2 Mn4 N24 O14
• Calculated formula: C66 H92 Fe2 Mn4 N24 O14
• Title of publication: 2[Mn(acacen)](+) + 1[Fe(CN)(5)NO](-) polynuclear heterobimetallic coordination compounds of different dimensionality in the solid state.
• Authors of publication: Peresypkina, Eugenia V.; Vostrikova, Kira E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 14
• Pages of publication: 4100 - 4106
• a: 20.6997 ± 0.0004 Å
• b: 20.6997 ± 0.0004 Å
• c: 9.9205 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4250.7 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0371
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.0731
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No