Information card for entry 8106149

Structure parameters

• Formula: C22 H22 N4 O16 S4 Zn3
• Calculated formula: C22 H22 N4 O16 S4 Zn3
• Title of publication: Crystal structure of poly[bis(1-methyl-[4,4′-bipyridin]-1-ium-κN)-tetrakis(μ3-sulfato-κ3 O:O′:O′′)trizinc(II)], C22H22Zn3N4O16S4
• Authors of publication: Fu, Hong-Ru; Wang, Kai-Lu; Zhao, Xiao-Xiao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 3
• Pages of publication: 349 - 351
• a: 9.2909 ± 0.0002 Å
• b: 16.8888 ± 0.0004 Å
• c: 19.3547 ± 0.0006 Å
• α: 90°
• β: 98.924 ± 0.003°
• γ: 90°
• Cell volume: 3000.22 ± 0.14 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: 0.046
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.0942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No