Information card for entry 4127298

Structure parameters

• Common name: (η5-C5Me5)4Rh5H7.0.5pentane
• Formula: C42.5 H73 Rh5
• Calculated formula: C42.5005 H73.001 Rh5
• Title of publication: Hydrogenation of <i>N</i>-Heteroarenes Using Rhodium Precatalysts: Reductive Elimination Leads to Formation of Multimetallic Clusters.
• Authors of publication: Kim, Sangmin; Loose, Florian; Bezdek, Máté J; Wang, Xiaoping; Chirik, Paul J.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• a: 11.8773 ± 0.0005 Å
• b: 13.7328 ± 0.0006 Å
• c: 15.6523 ± 0.0007 Å
• α: 92.034 ± 0.002°
• β: 111.67 ± 0.002°
• γ: 111.675 ± 0.002°
• Cell volume: 2160.73 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0272
• Weighted residual factors for significantly intense reflections: 0.0542
• Weighted residual factors for all reflections included in the refinement: 0.0574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No