Information card for entry 7002080

Structure parameters

• Common name: (iPr2Im)2(SMe)(pTolyl)Ni(ii)
• Chemical name: (iPr2Im)2(SMe)(pTolyl)Ni(II)
• Formula: C30 H46 N4 Ni S
• Calculated formula: C30 H46 N4 Ni S
• Title of publication: Facile C‒S, S‒H, and S‒S bond cleavage using a nickel(0) NHC complex
• Authors of publication: Schaub, Thomas; Backes, Marc; Plietzsch, Oliver; Radius, Udo
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 35
• Pages of publication: 7071
• a: 8.9551 ± 0.0018 Å
• b: 9.588 ± 0.0019 Å
• c: 19.095 ± 0.004 Å
• α: 95.19 ± 0.03°
• β: 99.35 ± 0.03°
• γ: 107.21 ± 0.03°
• Cell volume: 1528.5 ± 0.6 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1002
• Residual factor for significantly intense reflections: 0.0687
• Weighted residual factors for significantly intense reflections: 0.18
• Weighted residual factors for all reflections included in the refinement: 0.1942
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No