Information card for entry 2200361

Structure parameters

• Chemical name: Bis(quinoxaline-2,3-dithiolato-S,S')nickel(II)
• Formula: C16 H8 N4 Ni S4
• Calculated formula: C16 H8 N4 Ni S4
• SMILES: [Ni]12(Sc3c(nc4ccccc4n3)S1)Sc1c(nc3ccccc3n1)S2
• Title of publication: Bis(quinoxaline-2,3-dithiolato-<i>S</i>,<i>S</i>')nickel(II)
• Authors of publication: Zhao, Yingjun; Su, Weiping; Cao, Rong; Hong, Maochun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 6
• Pages of publication: m229 - m230
• a: 6.6528 ± 0.0002 Å
• b: 5.7251 ± 0.0002 Å
• c: 20.9637 ± 0.0008 Å
• α: 90°
• β: 90.205 ± 0.002°
• γ: 90°
• Cell volume: 798.46 ± 0.05 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0855
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections included in the refinement: 0.1633
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes