Information card for entry 2011591

Structure parameters

• Chemical name: Bis(μ-pyridine-2,6-carboxylato-N,O,O':O)bis[triaquamanganese(II)]‒ pyridine-2,6-dicarboxylic acid (1/2)
• Formula: C28 H28 Mn2 N4 O22
• Calculated formula: C28 H28 Mn2 N4 O22
• Title of publication: Bis(μ-pyridine-2,6-carboxylato-<i>O</i>,<i>N</i>,<i>O</i>':<i>O</i>)bis[triaquamanganese(II)]‒pyridine-2,6-dicarboxylic acid (1/2)
• Authors of publication: Okabe, Nobuo; Oya, Naomi
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 12
• Pages of publication: 1416 - 1417
• a: 9.166 ± 0.003 Å
• b: 14.603 ± 0.003 Å
• c: 12.192 ± 0.003 Å
• α: 90°
• β: 97.43 ± 0.02°
• γ: 90°
• Cell volume: 1618.2 ± 0.7 ų
• Cell temperature: 296 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes