Information card for entry 7114060

Structure parameters

• Chemical name: (R)-1-[(S)-2-diphenylphosphino)ferrocenyl]-ethyl-(S)-[phenylphosphin-2- (diphenylphosphino)ethane]
• Formula: C44 H41 Fe P3
• Calculated formula: C44 H41 Fe P3
• Title of publication: The first tridentate phosphine ligand combining planar, phosphorus and carbon chiralityElectronic supplementary information (ESI) available: experimental section. See http://www.rsc.org/suppdata/cc/b2/b208384a/
• Authors of publication: Barbaro, Pierluigi; Bianchini, Claudio; Giambastiani, Giuliano; Togni, Antonio
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 22
• Pages of publication: 2672
• a: 12.117 ± 0.002 Å
• b: 15.381 ± 0.009 Å
• c: 19.922 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3713 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1179
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1124
• Weighted residual factors for all reflections included in the refinement: 0.1423
• Goodness-of-fit parameter for all reflections included in the refinement: 0.88
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No