Information card for entry 7122006

Structure parameters

• Common name: methylbutylpyrrolidinium cadmium tris(dipropldithiocarbamte)
• Chemical name: (C4C1py)[Cd((nPr)2dtc)3]
• Formula: C33 H68 Cd N4 O S6
• Calculated formula: C33 H68 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: 15.564 ± 0.003 Å
• b: 15.533 ± 0.003 Å
• c: 18.558 ± 0.004 Å
• α: 90°
• β: 106.15 ± 0.03°
• γ: 90°
• Cell volume: 4309.4 ± 1.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0474
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.0959
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No