Information card for entry 7122008

Structure parameters

• Common name: (Pr4N)[Cd((iBu)2dtc)3].(CH3)CO
• Chemical name: tetrapropyammonium cadmium tris(diisobutyldithiocarbonate)
• Formula: C42 H88 Cd N4 O S6
• Calculated formula: C42 H88 Cd N4 O S6
• Title of publication: Cadmium tris(dithiocarbamate) ionic liquids as single source, solvent-free cadmium sulfide precursors.
• Authors of publication: Macreadie, Lauren K.; Forsyth, Craig M.; Turner, David R.; Chesman, Anthony S. R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 64
• Pages of publication: 8925 - 8928
• a: 21.093 ± 0.004 Å
• b: 22.769 ± 0.005 Å
• c: 10.847 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5209.5 ± 1.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0385
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No