Information card for entry 4072492

Structure parameters

• Chemical name: acetonitrile-(2-(1,10-phenanthroline)-ferrocenyl)-palladium(II) exafluorophosphate dichloromethane solvate
• Formula: C25 H20 Cl2 F6 Fe N3 P Pd
• Calculated formula: C25 H20 Cl2 F6 Fe N3 P Pd
• Title of publication: Palladium Chemistry of 2-Ferrocenyl-1,10-phenanthroline Ligand
• Authors of publication: Durand, Jérôme; Gladiali, Serafino; Erre, Giulia; Zangrando, Ennio; Milani, Barbara
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 4
• Pages of publication: 810
• a: 10.105 ± 0.003 Å
• b: 22.529 ± 0.005 Å
• c: 11.948 ± 0.004 Å
• α: 90°
• β: 96.86 ± 0.03°
• γ: 90°
• Cell volume: 2700.6 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.0784
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.1584
• Weighted residual factors for all reflections included in the refinement: 0.1709
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No