Information card for entry 4065743

Structure parameters

• Formula: C14 H25 Cl O2 P Rh
• Calculated formula: C14 H25 Cl O2 P Rh
• SMILES: [Rh]([P](CC1CC1)(C(C)(C)C)C(C)(C)C)(Cl)(C#[O])C#[O]
• Title of publication: C−C Bond Activation of a Cyclopropyl Phosphine: Isolation and Reactivity of a Tetrameric Rhodacyclobutane
• Authors of publication: Chaplin, Adrian B.; Weller, Andrew S.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 10
• Pages of publication: 2332
• a: 30.0493 ± 0.0004 Å
• b: 8.1298 ± 0.0001 Å
• c: 14.4869 ± 0.0003 Å
• α: 90°
• β: 101.648 ± 0.0005°
• γ: 90°
• Cell volume: 3466.19 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0416
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0559
• Weighted residual factors for all reflections included in the refinement: 0.0601
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No