Information card for entry 2013313

Structure parameters

• Common name: palladium-ethylxanthate
• Chemical name: bis(O-ethyl dithiocarbonato)palladium(II)
• Formula: C6 H10 O2 Pd S4
• Calculated formula: C6 H10 O2 Pd S4
• SMILES: O(C1=[S][Pd]2(S1)[S]=C(OCC)S2)CC
• Title of publication: Bis(<i>O</i>-ethyl dithiocarbonato-κ^2^<i>S</i>,<i>S</i>')palladium(II)
• Authors of publication: Ara, Irene; El Bahij, Fatima; Lachkar, Mohamed; Ben Larbi, Najib
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 5
• Pages of publication: m199 - m200
• a: 7.4958 ± 0.0006 Å
• b: 7.1942 ± 0.0006 Å
• c: 20.7522 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1119.09 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0384
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0545
• Weighted residual factors for all reflections included in the refinement: 0.0569
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes