Information card for entry 7718349

Structure parameters

• Formula: C51 H37 B F24 N4 O2 Pd
• Calculated formula: C51 H37 B F24 N4 O2 Pd
• Title of publication: The crucial role of acetonitrile in the mechanism of Pd(II)-catalyzed activation of polar vinyl monomers.
• Authors of publication: Alberoni, Chiara; Reusser, Esaïe; Balducci, Gabriele; Alessio, Enzo; Albrecht, Martin; Milani, Barbara
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 6876 - 6886
• a: 12.333 ± 0.0016 Å
• b: 12.475 ± 0.0009 Å
• c: 18.729 ± 0.002 Å
• α: 82.965 ± 0.003°
• β: 75.987 ± 0.006°
• γ: 71.443 ± 0.011°
• Cell volume: 2647.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.122
• Residual factor for significantly intense reflections: 0.1197
• Weighted residual factors for significantly intense reflections: 0.2769
• Weighted residual factors for all reflections included in the refinement: 0.2786
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.6199 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No