Information card for entry 4346445

Structure parameters

• Common name: Compound 5
• Formula: C38 H50 Cl4 N2 O8 Rh2
• Calculated formula: C38 H50 Cl4 N2 O8 Rh2
• Title of publication: Axial Ligand Coordination to the C-H Amination Catalyst Rh2(esp)2: A Structural and Spectroscopic Study.
• Authors of publication: Warzecha, Evan; Berto, Timothy C.; Berry, John F.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 17
• Pages of publication: 8817 - 8824
• a: 9.888 ± 0.003 Å
• b: 15.882 ± 0.004 Å
• c: 13.728 ± 0.003 Å
• α: 90°
• β: 92.222 ± 0.005°
• γ: 90°
• Cell volume: 2154.2 ± 1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.0174
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.0436
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No