Information card for entry 7001230

Structure parameters

• Formula: C29 H34 F7 I N P2 Rh
• Calculated formula: C29 H34 F7 I N P2 Rh
• SMILES: [Rh](I)([P](c1ccccc1)(C)C)([P](c1ccccc1)(C)C)(C)(C(F)(F)C(F)(F)C(F)(F)F)C#[N]c1c(cccc1C)C
• Title of publication: Synthesis of rhodium(i) and rhodium(iii) perfluoroalkyl complexes from [Rh(μ-OH)(COD)]2
• Authors of publication: Vicente, José; Gil-Rubio, Juan; Guerrero-Leal, Juan; Bautista, Delia
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 19
• Pages of publication: 3854 - 3866
• a: 11.4084 ± 0.0005 Å
• b: 11.6334 ± 0.0005 Å
• c: 13.1497 ± 0.0006 Å
• α: 88.019 ± 0.002°
• β: 76.668 ± 0.002°
• γ: 69.908 ± 0.002°
• Cell volume: 1592.92 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0201
• Residual factor for significantly intense reflections: 0.0191
• Weighted residual factors for significantly intense reflections: 0.0469
• Weighted residual factors for all reflections included in the refinement: 0.0474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No