Information card for entry 7013371

Structure parameters

• Common name: bis(3-(2-thienyl)-propenoic)-2,2'-disulfide acetone solvate
• Chemical name: bis{3-(2-thienyl)-propenoic}-2,2'-disulfide acetone solvate
• Formula: C17 H16 O5 S4
• Calculated formula: C14 H10 O4 S4
• Title of publication: Au‒O Interactions and others in triphenylphosphinegold(I) sulfanylpropenoates with diverse structures
• Authors of publication: Elena Barreiro; José S. Casas; María D. Couce; Agustín Sánchez; José Sordo; José M. Varela; Ezequiel M. Vázquez-López
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 24
• Pages of publication: 4754 - 4761
• a: 7.3669 ± 0.0007 Å
• b: 17.7955 ± 0.0017 Å
• c: 14.8798 ± 0.0015 Å
• α: 90°
• β: 96.63 ± 0.002°
• γ: 90°
• Cell volume: 1937.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1732
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1228
• Weighted residual factors for all reflections included in the refinement: 0.1459
• Goodness-of-fit parameter for all reflections included in the refinement: 0.775
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No