Information card for entry 2007666

Structure parameters

• Chemical name: Tetra-n-butylammonium Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II)
• Formula: C40 H72 N6 Ni S4
• Calculated formula: C40 H72 N6 Ni S4
• Title of publication: Bis(tetra-<i>n</i>-butylammonium) Bis(1,1-dicyanoethylene-2,2-dithiolato)nickelate(II)
• Authors of publication: Dong, Gang; Fronczek, Frank R.; Watkins, Steven F.; Bernal, Ivan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 9
• Pages of publication: IUC9800045
• a: 14.028 ± 0.001 Å
• b: 8.6312 ± 0.0006 Å
• c: 20.615 ± 0.002 Å
• α: 90°
• β: 108.21 ± 0.01°
• γ: 90°
• Cell volume: 2371 ± 0.4 ų
• Cell temperature: 294 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 significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.057
• Goodness-of-fit parameter for significantly intense reflections: 1.447
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes