Information card for entry 2013584

Structure parameters

• Chemical name: catena-Poly[[[(1,10-phenanthroline-κ^2^N,N')manganese(II)]-μ-L-tartrato- κ^2^O^1^:O^4^] hexahydrate]
• Formula: C16 H24 Mn N2 O12
• Calculated formula: C16 H24 Mn N2 O12
• SMILES: [Mn]123([n]4cccc5ccc6ccc[n]1c6c45)(OC(=O)[C@H]([OH]2)[C@@H](O)C(=O)[O-])[OH][C@H]([C@@H]([OH]1)C(=O)O[Mn]12[n]1cccc4ccc5ccc[n]2c5c14)C(=O)O3.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: <i>catena</i>-Poly[[[(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-<small>L</small>-tartrato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^3^,<i>O</i>^4^] hexahydrate]
• Authors of publication: Zhang, Xiaofeng; Huang Deguang; Chen Feng; Chen,Changneng; Liu, Qiutian; Sun, Licheng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 10
• Pages of publication: m402 - m404
• a: 6.7093 ± 0.0009 Å
• b: 15.336 ± 0.003 Å
• c: 20.21 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2079.5 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.032
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes