Information card for entry 7048043

Structure parameters

• Formula: C28 H21 F14 N9 P2 Pd
• Calculated formula: C28 H21 F14 N9 P2 Pd
• Title of publication: Electron-poor hemilabile dicationic palladium NHC complexes - synthesis, structure and catalytic activity.
• Authors of publication: Schroeter, Felix; Císařová, Ivana; Soellner, Johannes; Herdtweck, Eberhardt; Strassner, Thomas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 46
• Pages of publication: 16638 - 16650
• a: 16.0292 ± 0.0009 Å
• b: 11.2624 ± 0.0008 Å
• c: 18.3984 ± 0.0012 Å
• α: 90°
• β: 98.024 ± 0.002°
• γ: 90°
• Cell volume: 3288.9 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0536
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No