Information card for entry 4083984

Structure parameters

• Formula: C38 H36 N P2 Rh
• Calculated formula: C38 H36 N P2 Rh
• SMILES: [Rh]1([P](c2ccccc2)(c2ccccc2)CC[P]1(c1ccccc1)c1ccccc1)([n]1ccccc1)c1ccc(cc1)C
• Title of publication: Reactions of an Arylrhodium Complex with Aldehydes, Imines, Ketones, and Alkynones. New Classes of Insertion Reactions
• Authors of publication: Krug, Christopher; Hartwig, John F.
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 20
• Pages of publication: 4594 - 4607
• a: 11.128 ± 0.0018 Å
• b: 11.1646 ± 0.0018 Å
• c: 13.098 ± 0.002 Å
• α: 84.261 ± 0.003°
• β: 84.977 ± 0.003°
• γ: 80.62 ± 0.003°
• Cell volume: 1593.3 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.057
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No