Information card for entry 1519762

Structure parameters

• Formula: C19 H16 Cl2 N O P Pd
• Calculated formula: C19 H16 Cl2 N O P Pd
• SMILES: c12c(cccc1)C=[N](O)[Pd]([P]2(c1ccccc1)c1ccccc1)(Cl)Cl
• Title of publication: Palladium(II) complexes with a phosphino-oxime ligand: Synthesis, structure and applications to the catalytic rearrangement and dehydration of aldoximes
• Authors of publication: Menendez-Rodriguez, Lucia; Tomás-Mendivil, Eder; Francos, Javier; Najera, Carmen; Crochet, Pascale; Cadierno, Victorio
• Journal of publication: Catal. Sci. Technol.
• Year of publication: 2015
• a: 9.394 ± 0.0005 Å
• b: 10.5702 ± 0.0006 Å
• c: 19.7348 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1959.6 ± 0.17 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No