Information card for entry 2015756

Structure parameters

• Chemical name: Poly[diaqua(μ-4,4'-bipyridine)tetrakis(μ-ferrocenecarboxylato)bis(μ- ferrocenecarboxylato)trimanganese(II)]
• Formula: C76 H66 Fe6 Mn3 N2 O14
• Calculated formula: C76 H66 Fe6 Mn3 N2 O14
• Title of publication: Poly[diaqua(μ-4,4'-bipyridine)tetrakis(μ-ferrocenecarboxylato)bis(ferrocenecarboxylato)trimanganese(II)]
• Authors of publication: Wen-Jie Lu; Yi-Min Zhu; Kai-Long Zhong
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: m4 - m6
• a: 10.9891 ± 0.0011 Å
• b: 11.4986 ± 0.0011 Å
• c: 14.8928 ± 0.0015 Å
• α: 82.308 ± 0.002°
• β: 83.418 ± 0.002°
• γ: 66 ± 0.002°
• Cell volume: 1699.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0666
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.1023
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes