Information card for entry 2212674

Structure parameters

• Chemical name: catena-Poly[[2,2'-bipyridine-κ^2^N,N')manganese(II)]-μ-3,5- dinitro-2-oxidobenzoato-κ^4^O,O':O',O^2^]
• Formula: C17 H10 Mn N4 O7
• Calculated formula: C17 H10 Mn N4 O7
• SMILES: [Mn]123([n]4ccccc4c4cccc[n]14)([O]=C(c1cc(cc(c1[O-])N(=O)=O)N(=O)=O)O2)[O]1[Mn]2([n]4ccccc4c4cccc[n]24)[O]=C1c1cc(cc(c1O3)N(=O)=O)N(=O)=O
• Title of publication: <i>catena</i>-Poly[[(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')manganese(II)]-μ-3,5-dinitro-2-oxidobenzoato-κ^4^<i>O</i>,<i>O</i>':<i>O</i>',<i>O</i>^2^]
• Authors of publication: Wen-Dong Song; Xian-Xia Guo; Rong-Fa, Guo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 3
• Pages of publication: m737 - m739
• a: 8.8952 ± 0.0004 Å
• b: 23.8304 ± 0.0012 Å
• c: 8.5796 ± 0.0004 Å
• α: 90°
• β: 102.616 ± 0.003°
• γ: 90°
• Cell volume: 1774.76 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0879
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes