Information card for entry 2239248

Structure parameters

• Chemical name: {2,6-Bis[(pyridin-2-yl)sulfanylmethyl]pyridine-κ^2^<i>N</i>,<i>N</i>'}(η^3^-prop-2-enyl)palladium(II) hexafluorophosphate
• Formula: C20 H20 F6 N3 P Pd S2
• Calculated formula: C20 H20 F6 N3 P Pd S2
• Title of publication: {2,6-Bis[(pyridin-2-yl)sulfanylmethyl]pyridine-κ^2^<i>N</i>,<i>N</i>'}(η^3^-prop-2-enyl)palladium(II) hexafluorophosphate
• Authors of publication: Bruno, Giuseppe; Nicolò, Francesco; Tresoldi, Giuseppe; Drommi, Dario; Mollica Nardo, Viviana
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 4
• Pages of publication: m134 - m135
• a: 13.663 ± 0.001 Å
• b: 13.667 ± 0.001 Å
• c: 13.727 ± 0.001 Å
• α: 90°
• β: 113.01 ± 0.01°
• γ: 90°
• Cell volume: 2359.3 ± 0.3 ų
• Cell temperature: 293 ± 1 K
• Ambient diffraction temperature: 293 ± 1 K
• Number of distinct elements: 7
• 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: 0.042
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1138
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes