Information card for entry 2008169

Structure parameters

• Chemical name: Aquabis(2,2'-bipyridine-N,N')(perchlorato-O)-manganese(II) perchlorate
• Formula: C20 H18 Cl2 Mn N4 O9
• Calculated formula: C20 H16 Cl2 Mn N4 O9
• SMILES: [Mn]12([n]3ccccc3c3[n]1cccc3)([n]1ccccc1c1[n]2cccc1)([OH2])OCl(=O)(=O)=O.Cl(=O)(=O)(=O)[O-]
• Title of publication: Aquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(perchlorato-<i>O</i>)manganese(II) perchlorate
• Authors of publication: Rodríguez-Martín, Yolanda; González-Platas, Javier; Ruiz-Pérez, Catalina
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 186 - 188
• a: 8.744 ± 0.004 Å
• b: 14.219 ± 0.007 Å
• c: 19.552 ± 0.009 Å
• α: 90°
• β: 98.63 ± 0.04°
• γ: 90°
• Cell volume: 2403 ± 2 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 6
• 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: 0.121
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 1.54179 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No