Information card for entry 4074288

Structure parameters

• Formula: C14 H21 B Cl F4 N5 O Pd
• Calculated formula: C14 H21 B Cl F4 N5 O Pd
• Title of publication: Silver(I) and Palladium(II) Complexes of an Ether-Functionalized Quasi-pincer Bis-carbene Ligand and Its Alkyl Analogue
• Authors of publication: Nielsen, David J.; Cavell, Kingsley J.; Skelton, Brian W.; White, Allan H.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 20
• Pages of publication: 4850
• a: 11.685 ± 0.0009 Å
• b: 11.8826 ± 0.0009 Å
• c: 13.559 ± 0.001 Å
• α: 90°
• β: 93.115 ± 0.002°
• γ: 90°
• Cell volume: 1879.9 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• 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: 0.07
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections: 0.039
• Weighted residual factors for all reflections included in the refinement: 0.034
• Goodness-of-fit parameter for all reflections: 0.947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No