Information card for entry 2014165

Structure parameters

• Chemical name: bis[2,4,6-tris(2-pyridyl)-1,3,5-triazine-κ^2^N^2^,N^4^]zinc(II) hexaoxo-μ-peroxo-disulfate(VI) dihydrate
• Formula: C36 H28 N12 O10 S2 Zn
• Calculated formula: C36 H28 N12 O10 S2 Zn
• Title of publication: Three zinc(II) complexes presenting a ZnN~6~ chromophore and with peroxodisulfate as the counter-ion
• Authors of publication: Harvey, Miguel Angel; Baggio, Sergio; Ibañez, Andrés; Baggio, Ricardo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 8
• Pages of publication: m375 - m381
• a: 8.949 ± 0.0018 Å
• b: 9.782 ± 0.002 Å
• c: 43.031 ± 0.009 Å
• α: 90°
• β: 92.95 ± 0.03°
• γ: 90°
• Cell volume: 3761.9 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1398
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 0.829
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes