Information card for entry 7048286

Structure parameters

• Formula: C27.5 H34 B10 Cl3 N P2 Pd
• Calculated formula: C27.5 H34 B10 Cl3 N P2 Pd
• Title of publication: Electronic versus steric control in palladium complexes of carboranyl phosphine-iminophosphorane ligands.
• Authors of publication: Rodríguez-Rey, José Luis; Esteban-Gómez, David; Platas-Iglesias, Carlos; Sousa-Pedrares, Antonio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 2
• Pages of publication: 486 - 503
• a: 16.5388 ± 0.0016 Å
• b: 15.5576 ± 0.0014 Å
• c: 26.972 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6940 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1124
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1125
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No