Information card for entry 4072493

Structure parameters

• Chemical name: triphenylphosphine-(2-(1,10-phenanthroline)-ferrocenyl)-palladium(II) trifluoroacetate dichloromethane solvate
• Formula: C43 H32 Cl2 F3 Fe N2 O2 P Pd
• Calculated formula: C43 H30 Cl2 F3 Fe N2 O2 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: 10.708 ± 0.003 Å
• b: 10.965 ± 0.004 Å
• c: 17.713 ± 0.004 Å
• α: 102.76 ± 0.03°
• β: 90.78 ± 0.03°
• γ: 98.74 ± 0.02°
• Cell volume: 2002.4 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1107
• Residual factor for significantly intense reflections: 0.0731
• Weighted residual factors for significantly intense reflections: 0.2034
• Weighted residual factors for all reflections included in the refinement: 0.2367
• Goodness-of-fit parameter for all reflections included in the refinement: 0.914
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mokα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No