Information card for entry 4346446

Structure parameters

• Common name: Compound 6
• Formula: C35 H50.25 Cl1.75 O10.13 Rh2
• Calculated formula: C35 H50.253 Cl1.747 O10.1265 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: 11.6239 ± 0.001 Å
• b: 11.9813 ± 0.0008 Å
• c: 15.6522 ± 0.0009 Å
• α: 100.665 ± 0.006°
• β: 91.507 ± 0.006°
• γ: 115.278 ± 0.004°
• Cell volume: 1923.4 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0192
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0459
• Weighted residual factors for all reflections included in the refinement: 0.0461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No