Information card for entry 4326337

Structure parameters

• Common name: jonsk44
• Chemical name: (H-PONOP)PdCl
• Formula: C21 H40 Cl N O2 P2 Pd
• Calculated formula: C21 H40 Cl N O2 P2 Pd
• Title of publication: Synthesis and Reactivity of New Ni, Pd, and Pt 2,6-Bis(di-tert-butylphosphinito)pyridine Pincer Complexes
• Authors of publication: Sabuj Kundu; William W. Brennessel; William D. Jones
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 9443 - 9453
• a: 8.2561 ± 0.001 Å
• b: 11.9401 ± 0.0015 Å
• c: 13.3069 ± 0.0016 Å
• α: 100.829 ± 0.002°
• β: 95.463 ± 0.002°
• γ: 103.295 ± 0.002°
• Cell volume: 1240.7 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.1061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No