Information card for entry 4074946

Structure parameters

• Formula: C25 H26 F6 N4 O5 Pd
• Calculated formula: C25 H26 F6 N4 O5 Pd
• Title of publication: Mixed Dicarboxylato‒Bis(carbene) Complexes of Palladium(II): Synthesis, Structures, Trans‒Cis Isomerism, and Catalytic Activity
• Authors of publication: Huynh, Han Vinh; Neo, Tiong Cheng; Tan, Geok Kheng
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 5
• Pages of publication: 1298 - 1302
• a: 17.7749 ± 0.001 Å
• b: 13.2977 ± 0.0007 Å
• c: 12.944 ± 0.0007 Å
• α: 90°
• β: 106.566 ± 0.001°
• γ: 90°
• Cell volume: 2932.5 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0394
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1015
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No