Information card for entry 7024748

Structure parameters

• Chemical name: (7-azaindolato-κN1)(N,N-dimethylbenzylamine-κN,κC) (dimethylsulfoxid-κS)palladium(II).0.5hydrate.0.25toluene
• Formula: C79 H100 N12 O6 Pt4 S4
• Calculated formula: C79 H100 N12 O6 Pt4 S4
• Title of publication: New 7-azaindole palladium and platinum complexes: crystal structures and theoretical calculations. In vitro anticancer activity of the platinum compounds.
• Authors of publication: Ruiz, José; Rodríguez, Venancio; de Haro, Concepción; Espinosa, Arturo; Pérez, José; Janiak, Christoph
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 13
• Pages of publication: 3290 - 3301
• a: 8.6147 ± 0.0015 Å
• b: 10.4165 ± 0.0018 Å
• c: 21.917 ± 0.004 Å
• α: 84.523 ± 0.002°
• β: 87.574 ± 0.002°
• γ: 82.352 ± 0.002°
• Cell volume: 1939.5 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0559
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.23
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No