Information card for entry 4346242

Structure parameters

• Formula: C16 H13 F20 O2 P2 Rh
• Calculated formula: C16 H13 F20 O2 P2 Rh
• SMILES: [Rh]123(P(=O)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F)([P](O)(C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)F)[CH]5=[CH]2CC[CH]3=[CH]1CC5
• Title of publication: Transition Metal Complexes of Phosphinous Acids Featuring a Quasichelating Unit: Synthesis, Characterization, and Hetero-bimetallic Complexes.
• Authors of publication: Allefeld, Nadine; Bader, Julia; Neumann, Beate; Stammler, Hans-Georg; Ignat'ev, Nikolai; Hoge, Berthold
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 16
• Pages of publication: 7945 - 7952
• a: 8.7566 ± 0.0002 Å
• b: 17.8488 ± 0.0005 Å
• c: 15.6312 ± 0.0004 Å
• α: 90°
• β: 92.0264 ± 0.0016°
• γ: 90°
• Cell volume: 2441.55 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0571
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No