Information card for entry 4088301

Structure parameters

• Formula: C75 H74 Cl26 N16 Rh4
• Calculated formula: C75 H74 Cl26 N16 Rh4
• Title of publication: Preparation of Rhodium(III) Di-NHC Chelate Complexes Featuring Two Different NHC Donors via a Mild NaOAc-Assisted C‒H Activation
• Authors of publication: Aznarez, Francisco; Sanz Miguel, Pablo J.; Tan, Tristan T. Y.; Hahn, F. Ekkehardt
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 3
• Pages of publication: 410
• a: 11.4534 ± 0.0002 Å
• b: 11.7735 ± 0.0002 Å
• c: 18.7545 ± 0.0003 Å
• α: 95.024 ± 0.001°
• β: 98.125 ± 0.001°
• γ: 107.715 ± 0.001°
• Cell volume: 2361.91 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.049
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0778
• Weighted residual factors for all reflections included in the refinement: 0.0834
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No