Information card for entry 2015775

Structure parameters

• Chemical name: Poly[[[aqua(2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ- acetylenedicarboxylato-κ^3^O,O'O''] monohydrate]
• Formula: C14 H12 Mn N2 O6
• Calculated formula: C14 H12 Mn N2 O6
• Title of publication: Poly[[[aqua(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ~3~-acetylenedicarboxylato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>''] monohydrate]
• Authors of publication: Wang, Huan-Yu; Gao, Shan; Huo, Li-Hua; Zhao, Jing-Gui
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m65 - m67
• a: 18.769 ± 0.004 Å
• b: 42.406 ± 0.009 Å
• c: 7.217 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5744 ± 2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.021
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes