Information card for entry 2009956

Structure parameters

• Chemical name: cis-Bis(3-mercapto-1,3-bis(2-thienyl)-prop-2-enone-O,S)palladium(II)
• Formula: C22 H14 O2 Pd S6
• Calculated formula: C22 H11 O2 Pd S6
• Title of publication: <i>cis</i>-Bis[3-sulfido-1,3-bis(2-thienyl)prop-2-enone-<i>O</i>,<i>S</i>]palladium(II)
• Authors of publication: Baxter, Lesley A.M.; Blake, Alexander J.; Dijksma, Fokke J.J.; Gould, Robert O.; Heath, Graham A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 8
• Pages of publication: 1225 - 1227
• a: 20.596 ± 0.008 Å
• b: 10.622 ± 0.005 Å
• c: 21.523 ± 0.009 Å
• α: 90°
• β: 99.35 ± 0.03°
• γ: 90°
• Cell volume: 4646 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1811
• Residual factor for significantly intense reflections: 0.0603
• Weighted residual factors for all reflections: 0.1347
• Weighted residual factors for significantly intense reflections: 0.1167
• Goodness-of-fit parameter for all reflections: 0.793
• Goodness-of-fit parameter for significantly intense reflections: 1.14
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No