Information card for entry 7044797

Structure parameters

• Formula: C26 H47 N2 O3 P2 Rh
• Calculated formula: C26 H47 N2 O3 P2 Rh
• SMILES: [Rh]12([P](Cc3c2c(C[P]1(C(C)(C)C)C(C)(C)C)c(cc3C)C)(C(C)(C)C)C(C)(C)C)(N=O)N(=O)=O
• Title of publication: NO• Disproportionation by a {RhNO}9 Pincer-Type Complex
• Authors of publication: Gaviglio, Carina; Pellegrino, Juan; Milstein, David; Doctorovich, Fabio
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 8.6789 ± 0.0002 Å
• b: 23.1826 ± 0.0005 Å
• c: 14.3797 ± 0.0003 Å
• α: 90°
• β: 94.098 ± 0.002°
• γ: 90°
• Cell volume: 2885.79 ± 0.11 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0573
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0634
• Weighted residual factors for all reflections included in the refinement: 0.0738
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No