Information card for entry 4332304

Structure parameters

• Chemical name: catena-{(μ-pyrazine-2,5-dicarboxyato-N,O:N,O)-[diaquamanganese(II)]}
• Formula: C6 H6 Mn N2 O6
• Calculated formula: C6 H6 Mn N2 O6
• Title of publication: Supramolecular Architectures and Magnetic Properties of Coordination Polymers Based on Pyrazinedicarboxylato Ligands Showing Embedded Water Clusters
• Authors of publication: Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; García-Couceiro, Urko; García-Terán, Juan P.; Román, Pascual
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 14
• Pages of publication: 5367 - 5382
• a: 7.3114 ± 0.0006 Å
• b: 8.0108 ± 0.0007 Å
• c: 5.0255 ± 0.0004 Å
• α: 98.994 ± 0.006°
• β: 102.404 ± 0.007°
• γ: 127.77 ± 0.006°
• Cell volume: 210.85 ± 0.04 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor R(I) for significantly intense reflections: 3.1233
• Goodness-of-fit parameter for all reflections: 2.3
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No