Information card for entry 2243198

Structure parameters

• Chemical name: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')bis(2-methoxyethyl xanthato-κ<i>S</i>)zinc(II)
• Formula: C18 H22 N2 O4 S4 Zn
• Calculated formula: C18 H22 N2 O4 S4 Zn
• SMILES: C(=S)(OCCOC)S[Zn]1([n]2ccccc2c2cccc[n]12)SC(=S)OCCOC
• Title of publication: Crystal structure and Hirshfeld surface analysis of a zinc xanthate complex containing the 2,2'-bipyridine ligand
• Authors of publication: Qadir, Adnan M.; Kansiz, Sevgi; Rosair, Georgina M.; Dege, Necmi; Safyanova, Inna S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 12
• Pages of publication: 1857 - 1860
• a: 22.869 ± 0.004 Å
• b: 8.3212 ± 0.0012 Å
• c: 12.5627 ± 0.0019 Å
• α: 90°
• β: 115.348 ± 0.004°
• γ: 90°
• Cell volume: 2160.5 ± 0.6 ų
• Cell temperature: 100 ± 0.2 K
• Ambient diffraction temperature: 100 ± 0.2 K
• Number of distinct elements: 6
• 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: 0.0934
• Residual factor for significantly intense reflections: 0.0865
• Weighted residual factors for significantly intense reflections: 0.1525
• Weighted residual factors for all reflections included in the refinement: 0.1547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.429
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes