Information card for entry 7116460

Structure parameters

• Formula: C24 H27 Cl4 N2 Rh
• Calculated formula: C24 H27 Cl4 N2 Rh
• SMILES: [Rh]12345(c6cccc7c6N(CC7)c6cccc[n]56)([c]5([c]1([c]2([c]3([c]45C)C)C)C)C)Cl.C(Cl)(Cl)Cl
• Title of publication: Rhodium(iii)-catalyzed C7-position C-H alkenylation and alkynylation of indolines.
• Authors of publication: Yang, Xiao-Fei; Hu, Xu-Hong; Feng, Chao; Loh, Teck-Peng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 13
• Pages of publication: 2532 - 2535
• a: 26.7294 ± 0.0015 Å
• b: 8.902 ± 0.0005 Å
• c: 20.8098 ± 0.0011 Å
• α: 90°
• β: 90.4289 ± 0.0019°
• γ: 90°
• Cell volume: 4951.5 ± 0.5 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• 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: 0.1261
• Residual factor for significantly intense reflections: 0.0855
• Weighted residual factors for significantly intense reflections: 0.1836
• Weighted residual factors for all reflections included in the refinement: 0.2038
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No