Information card for entry 7013372

Structure parameters

• Common name: mu-3-(2-furyl)-2-sulfanylpropenoate-kappaS)- triphenylphosphine-kappaP-gold(i)
• Chemical name: mu-3-(2-furyl)-2-sulfanylpropenoate-kappaS}-triphenylphosphine- kappaP-gold(I)
• Formula: C25 H20 Au O3 P S
• Calculated formula: C25 H20 Au O3 P S
• SMILES: [Au]1(S/C(=C\c2ccco2)C(=O)[OH]1)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• 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: 11.2143 ± 0.0016 Å
• b: 27.397 ± 0.004 Å
• c: 15.353 ± 0.002 Å
• α: 90°
• β: 91.373 ± 0.003°
• γ: 90°
• Cell volume: 4715.7 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2698
• Residual factor for significantly intense reflections: 0.0566
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.1083
• Goodness-of-fit parameter for all reflections included in the refinement: 0.791
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No