Information card for entry 7012367

Structure parameters

• Common name: Mn[C5H3N(COO)2]H2O
• Formula: C7 H5 Mn N O5
• Calculated formula: C7 H5 Mn N O5
• Title of publication: Assembly of a manganese(II) pyridine-3,4-dicarboxylate polymeric network based on infinite Mn–O–C chains
• Authors of publication: Chen, Wei; Yue, Qi; Chen, Cheng; Yuan, Hong-Ming; Xu, Wei; Chen, Jie-Sheng; Wang, Su-Ning
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 1
• Pages of publication: 28 - 30
• a: 6.7055 ± 0.0014 Å
• b: 14.783 ± 0.003 Å
• c: 7.9166 ± 0.0015 Å
• α: 90°
• β: 100.724 ± 0.003°
• γ: 90°
• Cell volume: 771 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0859
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No