Information card for entry 4316357

Structure parameters

• Formula: C65 H120 Mn6 N2 O28
• Calculated formula: C64.98 H116.95 Mn6 N2 O27.74
• Title of publication: One-Dimensional Coordination Polymers from Hexanuclear Manganese Carboxylate Clusters Featuring a {MnII4MnIII2(μ4-O)2} Core and Spacer Linkers
• Authors of publication: Iurii L. Malaestean; Victor Ch. Kravtsov; Manfred Speldrich; Galina Dulcevscaia; Yurii A. Simonov; Janusz Lipkowski; Arkady Ellern; Svetlana G. Baca; Paul Kögerler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 7764 - 7772
• a: 28.566 ± 0.0014 Å
• b: 28.213 ± 0.0014 Å
• c: 24.042 ± 0.0016 Å
• α: 90 ± 0.002°
• β: 119.329 ± 0.003°
• γ: 90 ± 0.002°
• Cell volume: 16892.6 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1106
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.2156
• Weighted residual factors for all reflections included in the refinement: 0.2379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No