Information card for entry 4078943

Structure parameters

• Formula: C23 H31 I3 N6 O2 Rh2
• Calculated formula: C23 H31 I3 N6 O2 Rh2
• Title of publication: Y-Shaped Tris-N-Heterocyclic-Carbene Ligand for the Preparation of Multifunctional Catalysts of Iridium, Rhodium, and Palladium
• Authors of publication: Gonell, Sergio; Poyatos, Macarena; Mata, José A.; Peris, Eduardo
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 15
• Pages of publication: 5606
• a: 10.4283 ± 0.0003 Å
• b: 12.2666 ± 0.0003 Å
• c: 11.9217 ± 0.0003 Å
• α: 90°
• β: 96.174 ± 0.002°
• γ: 90°
• Cell volume: 1516.18 ± 0.07 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0541
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0823
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No