Information card for entry 1575973

Structure parameters

• Common name: Rh6
• Formula: C29 H40 B Cl3 F4 N3 O3 Rh Si
• Calculated formula: C29 H40 B Cl3 F4 N3 O3 Rh Si
• Title of publication: Confinement-induced Z-selectivity in the rhodium N-heterocyclic carbene-catalyzed hydroboration of terminal alkynes
• Authors of publication: Atwi, Boshra; Wang, Dongren; Bruckner, Johanna R.; Frey, Wolfgang; Buchmeiser, Michael R.
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 23
• Pages of publication: 7059 - 7066
• a: 7.181 ± 0.0006 Å
• b: 19.2695 ± 0.0018 Å
• c: 25.099 ± 0.002 Å
• α: 90°
• β: 98.181 ± 0.002°
• γ: 90°
• Cell volume: 3437.7 ± 0.5 ų
• Cell temperature: 145 ± 2 K
• Ambient diffraction temperature: 145 ± 2 K
• Number of distinct elements: 9
• 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: 0.0817
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1167
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No