Information card for entry 1506575

Structure parameters

• Formula: C14 H18 Cl2 F5 O2 P2 Rh
• Calculated formula: C14 H18 Cl2 F5 O2 P2 Rh
• SMILES: [Rh](Cl)(Cl)([P](C)(C)C)([P](C)(C)C)(C(=O)c1c(F)c(F)c(F)c(F)c1F)C#[O]
• Title of publication: CO-retentive addition reactions of fluorinated acid chlorides to alkynes.
• Authors of publication: Kashiwabara, Taigo; Kataoka, Kyoko; Hua, Ruimao; Shimada, Shigeru; Tanaka, Masato
• Journal of publication: Organic letters
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 11
• Pages of publication: 2241 - 2244
• a: 12.335 ± 0.003 Å
• b: 19.218 ± 0.003 Å
• c: 8.483 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2010.9 ± 0.8 ų
• Cell temperature: 183 ± 1 K
• Ambient diffraction temperature: 183 ± 1 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0474
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1571
• Weighted residual factors for all reflections included in the refinement: 0.1578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No