Information card for entry 2214952

Structure parameters

• Chemical name: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(5-thioxo-1,5-dihydro-1,3,4- thiadiazole-3-thiolato-κS)zinc(II)
• Formula: C14 H10 N6 S6 Zn
• Calculated formula: C14 H10 N6 S6 Zn
• SMILES: C1(=S)NN=C(S1)S[Zn]1([n]2c(c3cccc[n]13)cccc2)SC1=NNC(=S)S1
• Title of publication: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(5-thioxo-1,5-dihydro-1,3,4-thiadiazole-3-thiolato-κ<i>S</i>)zinc(II)
• Authors of publication: Zhang, Xiu-Ling; Qiu, Yu-E; Zhang, Cun-Lan; Xin, Bing-Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2381 - m2382
• a: 16.265 ± 0.005 Å
• b: 8.459 ± 0.003 Å
• c: 15.14 ± 0.005 Å
• α: 90°
• β: 94.459 ± 0.005°
• γ: 90°
• Cell volume: 2076.7 ± 1.2 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: 0.0418
• Residual factor for significantly intense reflections: 0.0275
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes