Information card for entry 4344173

Structure parameters

• Common name: Tetraphenylphosphonium bis(4,5-dimethylthiophene-2,3-dithiolate)gold
• Formula: C36 H32 Au P S6
• Calculated formula: C36 H32 Au P S6
• Title of publication: A Single-Component Conductor Based on a Radical Gold Dithiolene Complex with Alkyl-Substituted Thiophene-2,3-dithiolate Ligand.
• Authors of publication: Higashino, Toshiki; Jeannin, Olivier; Kawamoto, Tadashi; Lorcy, Dominique; Mori, Takehiko; Fourmigué, Marc
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 20
• Pages of publication: 9908 - 9913
• a: 10.6373 ± 0.0005 Å
• b: 11.9558 ± 0.0019 Å
• c: 14.8591 ± 0.0006 Å
• α: 101.782 ± 0.0016°
• β: 97.6679 ± 0.0013°
• γ: 104.631 ± 0.0012°
• Cell volume: 1755.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1056
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.14
• Weighted residual factors for all reflections included in the refinement: 0.1523
• Goodness-of-fit parameter for all reflections included in the refinement: 1.219
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No