Information card for entry 1569228

Structure parameters

• Formula: C25.14 H11.43 F11.43 N2.29 Pd1.14
• Calculated formula: C25.1429 H11.4286 F11.4286 N2.28571 Pd1.14286
• Title of publication: Palladium mono-<i>N</i>-protected amino acid complexes: experimental validation of the ligand cooperation model in C-H activation.
• Authors of publication: Fernández-Moyano, Sara; Salamanca, Vanesa; Albéniz, Ana C
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 24
• Pages of publication: 6688 - 6694
• a: 9.8649 ± 0.0003 Å
• b: 34.9214 ± 0.0014 Å
• c: 13.1305 ± 0.0005 Å
• α: 90°
• β: 109.505 ± 0.004°
• γ: 90°
• Cell volume: 4263.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0689
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No