Information card for entry 1517149

Structure parameters

• Formula: C24 H20 N6 O6 Pd S2
• Calculated formula: C24 H20 N6 O6 Pd S2
• SMILES: [Pd](N1S(=O)(=O)c2c(C1=O)cccc2)(N1S(=O)(=O)c2c(C1=O)cccc2)([n]1ccccc1N)[n]1ccccc1N
• Title of publication: Palladium(II) saccharinate (sac) and thiosaccharinate (tsac) complexes with 2-aminopyridine (2-ampy), 2-acetylaminopyridine (2-aampy) and 2-acetylaminopyrimidine (2-aampym) co-ligands: X-ray crystal structures of trans-[Pd(sac)2(ampy)2] and solvatomorphs trans-[Pd(sac)2(2-aampy)2].S (S = CHCl3, thf)
• Authors of publication: Subhi A. Al-Jibori; Qusay K.A. Al-Jibori; Harry Schmidt; Kurt Merzweiler; Christoph Wagner; Graeme Hogarth
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 402
• Pages of publication: 69 - 74
• a: 7.992 ± 0.003 Å
• b: 8.493 ± 0.003 Å
• c: 10.489 ± 0.004 Å
• α: 84.691 ± 0.005°
• β: 71.313 ± 0.005°
• γ: 72.822 ± 0.005°
• Cell volume: 644.3 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1571
• Weighted residual factors for all reflections included in the refinement: 0.1652
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No