Information card for entry 4111346

Structure parameters

• Formula: C39 H42 Cl3 N2 P Re
• Calculated formula: C39 H42 Cl3 N2 P Re
• Title of publication: Mechanistic Insight into Hydrosilylation Reactions Catalyzed by High Valent Re\τbX (X = O, NAr, or N) Complexes: The Silane (SiH) Does Not Add across the Metal-Ligand Multiple Bond
• Authors of publication: Guodong Du; Phillip E. Fanwick; Mahdi M. Abu-Omar
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 5180 - 5187
• a: 11.8396 ± 0.0005 Å
• b: 12.8071 ± 0.0005 Å
• c: 13.6137 ± 0.0007 Å
• α: 72.664 ± 0.002°
• β: 76.118 ± 0.002°
• γ: 70.558 ± 0.002°
• Cell volume: 1835.27 ± 0.14 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.059
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No