Information card for entry 7049324

Structure parameters

• Formula: C85 H123 O2 P4 Pd2
• Calculated formula: C85 H123 O2 P4 Pd2
• Title of publication: Oxidation reactions of a nucleophilic palladium carbene: mono and bi-radical carbenes.
• Authors of publication: Cui, Peng; Hoffbauer, Melissa R.; Vyushkova, Mariya; Iluc, Vlad M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 26
• Pages of publication: 9663 - 9668
• a: 11.8407 ± 0.0012 Å
• b: 13.4567 ± 0.0013 Å
• c: 13.9043 ± 0.0013 Å
• α: 100.199 ± 0.003°
• β: 109.735 ± 0.002°
• γ: 98.037 ± 0.003°
• Cell volume: 2004.2 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0287
• Weighted residual factors for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.0724
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No