Information card for entry 4080066

Structure parameters

• Formula: C13.89 H18.65 Cl1.12 N4 Pd
• Calculated formula: C13.88 H18.64 Cl1.12 N4 Pd
• Title of publication: Ethylene and Styrene Carbon Monoxide Copolymerization Catalyzed by Pyrazolyl Palladium(II) Complexes
• Authors of publication: Obuah, Collins; Ainooson, Michael K.; Boltina, Sibulele; Guzei, Ilia A.; Nozaki, Kyoko; Darkwa, James
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 4
• Pages of publication: 980
• a: 8.5965 ± 0.0006 Å
• b: 8.9504 ± 0.0006 Å
• c: 10.9882 ± 0.0007 Å
• α: 74.511 ± 0.001°
• β: 79.202 ± 0.001°
• γ: 70.451 ± 0.001°
• Cell volume: 763.3 ± 0.09 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0216
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0547
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No