Information card for entry 7026467

Structure parameters

• Formula: C56 H68 B F24 P2 Rh
• Calculated formula: C56 H67 B F24 P2 Rh
• Title of publication: Reversible C-H activation of a P(t)Bu(i)Bu2 ligand to reveal a masked 12 electron [Rh(PR3)2]+ cation.
• Authors of publication: Sewell, Laura J.; Chaplin, Adrian B.; Abdalla, Joseph A. B.; Weller, Andrew S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 32
• Pages of publication: 7437 - 7439
• a: 12.8805 ± 0.0001 Å
• b: 13.0528 ± 0.0001 Å
• c: 22.3154 ± 0.0002 Å
• α: 103.198 ± 0.0003°
• β: 94.4213 ± 0.0004°
• γ: 118.412 ± 0.0004°
• Cell volume: 3136.25 ± 0.05 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.1669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No