Information card for entry 2207662

Structure parameters

• Chemical name: [(1,10‒phenanthroline‒κ~2~N,N')(2,3‒pyridinedicarboxylate) manganese(II)].hydrate
• Formula: C19 H13 Mn N3 O5
• Calculated formula: C19 H13 Mn N3 O5
• Title of publication: Poly[[(1,10-phenanthroline)(μ~3~-pyridine-2,3-dicarboxylato)manganese(II)] monohydrate]
• Authors of publication: Xue-Li Niu; Jian-Min Dou; Chang-Wen Hu; Da-Cheng Li; Da-Qi Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: m2507 - m2509
• a: 11.649 ± 0.004 Å
• b: 11.774 ± 0.004 Å
• c: 13.292 ± 0.004 Å
• α: 90°
• β: 109.939 ± 0.005°
• γ: 90°
• Cell volume: 1713.8 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1188
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1626
• Weighted residual factors for all reflections included in the refinement: 0.196
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes