Information card for entry 4073885

Structure parameters

• Formula: C33 H34 Cl4 N P Pd
• Calculated formula: C33 H34 Cl4 N P Pd
• Title of publication: Versatility of Iminophosphoranes and Noninnocent Behavior of the 1,5-Cyclooctadiene Ligand in Palladium(II) Complexes. Synthesis of σ-Allyl Derivatives
• Authors of publication: Aguilar, David; Aznárez, Francisco; Bielsa, Raquel; Falvello, Larry R.; Navarro, Rafael; Urriolabeitia, Esteban P.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6397
• a: 19.369 ± 0.004 Å
• b: 12.15 ± 0.002 Å
• c: 27.89 ± 0.006 Å
• α: 90°
• β: 103.74 ± 0.03°
• γ: 90°
• Cell volume: 6376 ± 2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.1088
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No