Information card for entry 7049385

Structure parameters

• Chemical name: [Pd{?1-NIM-[N-(diphenylboryl)picolinaldimine]}Cl(C3H5)].
• Formula: C21 H20 B Cl N2 Pd
• Calculated formula: C21 H20 B Cl N2 Pd
• Title of publication: Synthesis, structure and palladium coordination of ambiphilic, pyridine- and phosphine-tethered N-boryl imine ligands.
• Authors of publication: Lorenzini, Fabio; Lagueux-Tremblay, Pierre-Louis; Kayser, Laure V.; Anderson, Ethan; Arndtsen, Bruce A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 17
• Pages of publication: 5766 - 5772
• a: 9.789 ± 0.006 Å
• b: 15.693 ± 0.009 Å
• c: 25.897 ± 0.015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3978 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0746
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No