Information card for entry 4062101

Structure parameters

• Formula: C24 H32 F12 N3 O2 P2 Rh
• Calculated formula: C24 H32 F12 N3 O2 P2 Rh
• SMILES: [Rh]123456([CH]7=[CH]1CC2[CH]3=[CH]4CC7)[n]1c(C[NH]6Cc2[n]5cccc2)cccc1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].O1CCOCC1
• Title of publication: Disproportionation of Rh^II^(cod) to Rh^I^(cod) and Rh^III^(cycloocta-2,5-dien-1-yl); Hydrogen atom transfer vs electron and proton transfer.
• Authors of publication: Hetterscheid, Dennis G.H.; de Bruin, Bas; Smits, Jan M. M.; Gal, Anton W.
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 10.972 ± 0.0012 Å
• b: 15.514 ± 0.003 Å
• c: 18.219 ± 0.0018 Å
• α: 90°
• β: 100.562 ± 0.01°
• γ: 90°
• Cell volume: 3048.7 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0791
• Weighted residual factors for significantly intense reflections: 0.1951
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No