Information card for entry 4069008

Structure parameters

• Formula: C43 H49 B F4 N O6 P2 Rh
• Calculated formula: C43 H49 B F4 N O6 P2 Rh
• SMILES: [Rh]123([P@](CC[P@@]1(c1c(OC)cccc1)c1ccccc1)(c1c(OC)cccc1)c1ccccc1)[O]=C(N[C]2(=[CH]3c1ccccc1)C(=O)OC)C.[B](F)(F)(F)[F-].OC(C)C
• Title of publication: Asymmetric Hydrogenation. Dimerization of Solvate Complexes: Synthesis and Characterization of Dimeric [Rh(DIPAMP)]22+, a Valuable Catalyst Precursor
• Authors of publication: Preetz, Angelika; Baumann, Wolfgang; Fischer, Christian; Drexler, Hans-Joachim; Schmidt, Thomas; Thede, Richard; Heller, Detlef
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 13
• Pages of publication: 3673
• a: 10.391 ± 0.002 Å
• b: 15.356 ± 0.003 Å
• c: 26.626 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4248.6 ± 1.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• 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: 0.0624
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0929
• Goodness-of-fit parameter for all reflections included in the refinement: 0.874
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No