Information card for entry 7712313

Structure parameters

• Chemical name: VL203
• Formula: C31 H39 Cl3 N O2 P Pd
• Calculated formula: C31 H39 Cl3 N O2 P Pd
• Title of publication: Synthesis, characterization, and reactivity of [Pd(phosphine)(py)Cl2] (PEPPSI) and [Pd(phosphine)Cl2]2 com-plexes
• Authors of publication: Nolan, Steven P.; Voloshkin, Vladislav; Belis, Marek; Cazin, Catherine; Peng, Min; Liu, Yaxu; Van Hecke, Kristof
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 8.7409 ± 0.0001 Å
• b: 16.5403 ± 0.0002 Å
• c: 21.5878 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3121.1 ± 0.07 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.026
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No