Information card for entry 7112976

Structure parameters

• Formula: C34 H42 F6 O2 P3 Rh
• Calculated formula: C34 H42 F6 O2 P3 Rh
• Title of publication: Rational design of efficient rhodium catalysts for the anti-Markovnikov oxidative amination of styrene.
• Authors of publication: Jiménez, M Victoria; Pérez-Torrente, Jesús J; Bartolomé, M Isabel; Lahoz, Fernando J.; Oro, Luis A.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 29
• Pages of publication: 5322 - 5324
• a: 18.813 ± 0.002 Å
• b: 17.919 ± 0.002 Å
• c: 20.796 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7010.5 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1225
• Weighted residual factors for all reflections included in the refinement: 0.1301
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No