Information card for entry 2208466

Structure parameters

• Chemical name: Bis(N-ethylpyridinium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate(II)
• Formula: C20 H20 N2 S10 Zn
• Calculated formula: C20 H20 N2 S10 Zn
• SMILES: C1(=S)SC2S[Zn]3(SC=2S1)SC1=C(S3)SC(=S)S1.c1cc[n+](CC)cc1.CC[n+]1ccccc1
• Title of publication: Bis(<i>N</i>-ethylpyridinium) bis(2-thioxo-1,3-dithiole-4,5-dithiolato)zincate(II)
• Authors of publication: Wang, Yan-Ling; Yu, Wen-Tao; Chen, Hong-Yu; Xu, Dong; Guo, Wen-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: m623 - m624
• a: 19.948 ± 0.004 Å
• b: 14.733 ± 0.003 Å
• c: 10.001 ± 0.002 Å
• α: 90°
• β: 106.934 ± 0.002°
• γ: 90°
• Cell volume: 2811.8 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes