Information card for entry 2234107

Structure parameters

• Chemical name: <i>trans</i>-Bis(5-amino-1,3,4-thiadiazol-2-thiolato- κ<i>S</i>^2^)bis(triphenylphosphane-κ<i>P</i>)palladium(II) dimethyl sulfoxide disolvate hemihydrate
• Formula: C44 H47 N6 O2.5 P2 Pd S6
• Calculated formula: C44 H46 N6 O2.5 P2 Pd S6
• Title of publication: <i>trans</i>-Bis(5-amino-1,3,4-thiadiazol-2-thiolato-κ<i>S</i>^2^)bis(triphenylphosphane-κ<i>P</i>)palladium(II) dimethyl sulfoxide disolvate hemihydrate
• Authors of publication: Chontal-Vidal, Felipe; Arroyo-Gómez, Maricela; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m483 - m484
• a: 14.6192 ± 0.0018 Å
• b: 13.2572 ± 0.0016 Å
• c: 25.707 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4982.3 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.12
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.137
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes