Information card for entry 2202995

Structure parameters

• Formula: C12 H16 Mn N4 O10
• Calculated formula: C12 H16 Mn N4 O10
• SMILES: c1[n]2[Mn]([n]3cccc4ccc(cc1)c2c34)([OH2])([OH2])([OH2])[OH2].N(=O)(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Tetraaqua(1,10-phenanthroline-<i>N,N</i>')manganese(II) dinitrate
• Authors of publication: Wang, Wenguo; Ma, Chengbing; Chen, Feng; Chen,Changneng; Liu, Qiutian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 10
• Pages of publication: m908 - m910
• a: 14.144 ± 0.002 Å
• b: 10.6484 ± 0.0015 Å
• c: 12.2202 ± 0.0019 Å
• α: 90°
• β: 101.356 ± 0.003°
• γ: 90°
• Cell volume: 1804.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1064
• Weighted residual factors for all reflections included in the refinement: 0.1314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes