Information card for entry 4079962

Structure parameters

• Common name: 9Pd
• Formula: C24 H43 F3 N O3 P Pd S
• Calculated formula: C24 H43 F3 N O3 P Pd S
• Title of publication: Investigation of Steric and Electronic Features of 3-Iminophosphine-Based Palladium Catalysts for Intermolecular Hydroamination
• Authors of publication: Zingales, Nicholas C.; Shaffer, Andrew R.; Schmidt, Joseph A. R.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 2
• Pages of publication: 578
• a: 22.407 ± 0.003 Å
• b: 11.3067 ± 0.0016 Å
• c: 22.479 ± 0.003 Å
• α: 90°
• β: 91.578 ± 0.001°
• γ: 90°
• Cell volume: 5692.9 ± 1.3 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0574
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1296
• Weighted residual factors for all reflections included in the refinement: 0.1365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No