Information card for entry 2224847

Structure parameters

• Chemical name: Bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(sulfato- κ^2^<i>O</i>,<i>O</i>')zinc(II) ethane-1,2-diol solvate
• Formula: C22 H22 N4 O6 S Zn
• Calculated formula: C22 H22 N4 O6 S Zn
• SMILES: c1cccc2c3cccc[n]3[Zn]34([n]12)(OS(=O)(=O)O4)[n]1ccccc1c1cccc[n]31.OCCO
• Title of publication: Bis(2,2'-bipyridyl-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')zinc(II) ethane-1,2-diol solvate
• Authors of publication: Zhong, Kai-Long
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: m131
• a: 17.017 ± 0.003 Å
• b: 11.89 ± 0.002 Å
• c: 12.831 ± 0.003 Å
• α: 90°
• β: 122.14 ± 0.03°
• γ: 90°
• Cell volume: 2198.3 ± 1 ų
• Cell temperature: 223.15 K
• Ambient diffraction temperature: 223.15 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes