Information card for entry 4313706

Structure parameters

• Formula: C14 H19 F5 N2 O2 Pd
• Calculated formula: C14 H19 F5 N2 O2 Pd
• SMILES: [Pd]1([N](CC[N]1(C)C)(C)C)(c1c(F)c(F)c(F)c(F)c1F)C(=O)OC
• Title of publication: Insertion Reactions into Pd-O and Pd-N Bonds: Preparation of Alkoxycarbonyl, Carbonato, Carbamato, Thiocarbamate, and Thioureide Complexes of Palladium(II)
• Authors of publication: José Ruiz; M. Teresa Martínez; Félix Florenciano; Venancio Rodríguez; Gregorio López; José Pérez; Penny A. Chaloner; Peter B. Hitchcock
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3650 - 3661
• a: 11.792 ± 0.002 Å
• b: 13.37 ± 0.003 Å
• c: 11.498 ± 0.002 Å
• α: 90°
• β: 96.37 ± 0.02°
• γ: 90°
• Cell volume: 1801.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.054
• Residual factor for significantly intense reflections: 0.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No