Information card for entry 7027497

Structure parameters

• Common name: [Pd(C6F5)2{NC(Me)OMe}2]
• Formula: C18 H12 F10 N2 O2 Pd
• Calculated formula: C18 H12 F10 N2 O2 Pd
• SMILES: [Pd](/[NH]=C(OC)\C)(/[NH]=C(OC)\C)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: Reactivity of hydroxo complexes of palladium(II) towards nitriles: formation of carboxamide and imino ether derivatives of palladium(II)
• Authors of publication: Ruiz, José; Cutillas, Natalia; Rodríguez, Venancio; Sampedro, José; López, Gregorio; Chaloner, Penny A.; Hitchcock, Peter B.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 2939
• a: 9.243 ± 0.003 Å
• b: 14.634 ± 0.006 Å
• c: 15.865 ± 0.003 Å
• α: 90°
• β: 94.71 ± 0.02°
• γ: 90°
• Cell volume: 2138.7 ± 1.2 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for all reflections: 0.1212
• Weighted residual factors for significantly intense reflections: 0.101
• Goodness-of-fit parameter for all reflections: 1.019
• Goodness-of-fit parameter for significantly intense reflections: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No