Information card for entry 8107230

Structure parameters

• Formula: C20 H14 N6 S4 Zn
• Calculated formula: C20 H14 N6 S4 Zn
• Title of publication: Crystal structure of 1,1′-(1,2-ethanediyl)bis(pyridin-1-ium) bis(1,2-dicyanoethene-1,2-dithiolato-κ2 S:S)zinc(II), C20H14N6ZnS4
• Authors of publication: Liu, Xue-Guo; Chen, Wan-Yao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 5
• Pages of publication: 837 - 839
• a: 8.5063 ± 0.0013 Å
• b: 12.3254 ± 0.0019 Å
• c: 21.843 ± 0.003 Å
• α: 90°
• β: 96.55 ± 0.002°
• γ: 90°
• Cell volume: 2275.1 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.036
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No