Information card for entry 7027547

Structure parameters

• Formula: C14 H21 Cl1.5 N2 O2.5 Rh0.5
• Calculated formula: C14 H14 Cl1.5 N2 O2.5 Rh0.5
• Title of publication: Rhodium(III)-mediated oxime‒nitrile coupling giving chelated iminoacylated species †
• Authors of publication: Yu. Kukushkin, Vadim; Ilichev, Igor V.; Wagner, Gabriele; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 3047
• a: 8.866 ± 0.002 Å
• b: 10.358 ± 0.002 Å
• c: 10.952 ± 0.002 Å
• α: 109.58 ± 0.03°
• β: 97.65 ± 0.03°
• γ: 112.09 ± 0.03°
• Cell volume: 838.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0332
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0907
• Weighted residual factors for all reflections included in the refinement: 0.0907
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No