Information card for entry 7029675

Structure parameters

• Formula: C28 H47 B F3 O5 P2 Rh
• Calculated formula: C28 H47 B F3 O5 P2 Rh
• SMILES: [Rh](C1=[O][B]2(OC1(C(F)(F)F)c1ccccc1)OC(C(O2)(C)C)(C)C)([P](CC)(CC)CC)([P](CC)(CC)CC)C#[O]
• Title of publication: Versatile reactivity of a rhodium(i) boryl complex towards ketones and imines.
• Authors of publication: Kalläne, Sabrina I; Braun, Thomas; Braun, Beatrice; Mebs, Stefan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 18
• Pages of publication: 6786 - 6801
• a: 10.424 ± 0.0005 Å
• b: 29.0136 ± 0.0013 Å
• c: 13.0004 ± 0.0006 Å
• α: 90°
• β: 124.428 ± 0.003°
• γ: 90°
• Cell volume: 3243.1 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0679
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.1021
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No