Information card for entry 8106062

Structure parameters

• Formula: C14 H16 N6 Ni S4
• Calculated formula: C14 H16 N6 Ni S4
• Title of publication: Crystal structure of bis(N′-((1H-pyrrol-2-yl)methylene)-1-methylthio-methanethiohydrazido-κ2 S,N)nickel(II), C14H16N6NiS4
• Authors of publication: Lin, Long; Zhu, Ling-Hao; Wang, Yuan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 1
• Pages of publication: 105 - 106
• a: 8.817 ± 0.016 Å
• b: 10.172 ± 0.017 Å
• c: 10.043 ± 0.017 Å
• α: 90°
• β: 97.77 ± 0.04°
• γ: 90°
• Cell volume: 892 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.138
• Residual factor for significantly intense reflections: 0.0788
• Weighted residual factors for significantly intense reflections: 0.1725
• Weighted residual factors for all reflections included in the refinement: 0.1962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No