Information card for entry 4504191

Structure parameters

• Chemical name: catena-((μ6-pyridine-2,4,6-carboxylato)- μ3-hydroxy-aqua-di-manganese(II))
• Formula: C8 H5 Mn2 N O8
• Calculated formula: C8 H5 Mn2 N O8
• Title of publication: A Novel Five-Connected BN Topological Network Metal−Organic Framework Mn(II) Cluster Complex
• Authors of publication: Wang, Xian-Wen; Dong, You-Ren; Zheng, Yue-Qing; Chen, Jing-Zhong
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 4
• Pages of publication: 613
• a: 6.7169 ± 0.0007 Å
• b: 9.0656 ± 0.0008 Å
• c: 9.1565 ± 0.001 Å
• α: 74.93 ± 0.007°
• β: 74.262 ± 0.008°
• γ: 70.52 ± 0.007°
• Cell volume: 497.03 ± 0.09 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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 for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.123
• Weighted residual factors for all reflections included in the refinement: 0.1621
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No