Information card for entry 2019813

Structure parameters

• Chemical name: (μ-<i>N</i>,<i>N</i>'-Dibenzyldithiooxamidato-κ<i>N</i>,<i>S</i>:<i>N</i>',<i>S</i>')bis[(η^3^-crotyl)palladium(II)]
• Formula: C24 H28 N2 Pd2 S2
• Calculated formula: C24 H28 N2 Pd2 S2
• SMILES: S1C2C(S[Pd]34(C[CH]3=[CH]4C)[N]=2Cc2ccccc2)=[N]([Pd]231[CH](=[CH]2C)C3)Cc1ccccc1
• Title of publication: Crystal structure of (μ-N,N′-dibenzyldithiooxamidato-κN,S:N′,S′)bis[(η3-crotyl)palladium(II)]
• Authors of publication: Bruno, Giuseppe; Lanza, Santo; Giannetto, Antonino; Sacca, Alessandro; Amiri Rudbari, Hadi
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 2
• Pages of publication: m40
• a: 18.324 ± 0.0002 Å
• b: 7.166 ± 0.0001 Å
• c: 19.508 ± 0.0002 Å
• α: 90°
• β: 109.341 ± 0.004°
• γ: 90°
• Cell volume: 2417.03 ± 0.08 ų
• Cell temperature: 298 ± 1 K
• Ambient diffraction temperature: 298 ± 1 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for all reflections included in the refinement: 0.0846
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes