Information card for entry 7013079

Structure parameters

• Formula: C30 H20 F6 N2 O4 Pd2
• Calculated formula: C30 H20 F6 N2 O4 Pd2
• Title of publication: Phosphine and arsine adducts of N-donor palladacycles as catalysts in the Suzuki coupling of aryl bromides
• Authors of publication: Robin B. Bedford; Catherine S. J. Cazin; Simon J. Coles; Thomas Gelbrich; Michael B. Hursthouse; Véronique J. M. Scordia
• Journal of publication: Dalton Trans.
• Year of publication: 2003
• Journal issue: 17
• Pages of publication: 3350 - 3356
• a: 9.634 ± 0.0002 Å
• b: 11.3047 ± 0.0003 Å
• c: 14.338 ± 0.0003 Å
• α: 68.036 ± 0.0015°
• β: 85.273 ± 0.0015°
• γ: 88.409 ± 0.0009°
• Cell volume: 1443.27 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0504
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1071
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No