Information card for entry 2225381

Structure parameters

• Chemical name: Bis(<i>N</i>-butyl-<i>N</i>-ethyldithiocarbamato- κ^2^<i>S</i>,<i>S</i>')nickel(II)
• Formula: C14 H28 N2 Ni S4
• Calculated formula: C14 H28 N2 Ni S4
• SMILES: C1(N(CCCC)CC)=[S][Ni]2(S1)[S]=C(N(CCCC)CC)S2
• Title of publication: Bis(<i>N</i>-butyl-<i>N</i>-ethyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')nickel(II)
• Authors of publication: Wan Juhari, Wan Nur Shazwani; Baba, Ibrahim; Farina, Yang; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m339
• a: 8.5641 ± 0.0009 Å
• b: 8.6316 ± 0.0009 Å
• c: 13.6047 ± 0.0014 Å
• α: 90°
• β: 94.753 ± 0.002°
• γ: 90°
• Cell volume: 1002.23 ± 0.18 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0571
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0841
• Weighted residual factors for all reflections included in the refinement: 0.0982
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes