Information card for entry 2239559

Structure parameters

• Chemical name: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')dichloridopalladium(II) 1,4-dioxane hemisolvate
• Formula: C12 H12 Cl2 N2 O Pd
• Calculated formula: C12 H12 Cl2 N2 O Pd
• SMILES: [n]12[Pd]([n]3ccccc3c1cccc2)(Cl)Cl.O1CCOCC1
• Title of publication: (2,2'-Bipyridine-κ^2^<i>N</i>,<i>N</i>')dichloridopalladium(II) 1,4-dioxane hemisolvate
• Authors of publication: Gutiérrez Márquez, Ricardo Alfredo; Crisóstomo-Lucas, Carmela; Morales-Morales, David; Hernández-Ortega, Simón
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: m218
• a: 7.2416 ± 0.0005 Å
• b: 14.6215 ± 0.001 Å
• c: 12.9562 ± 0.0009 Å
• α: 90°
• β: 105.423 ± 0.002°
• γ: 90°
• Cell volume: 1322.44 ± 0.16 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0685
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1365
• Weighted residual factors for all reflections included in the refinement: 0.1532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes