Abstract
The conformational free energy (A value) of the trifluoromethyl group was determined by variable temperature 19F NMR studies of trifluoromethylcyclohexanes bearing a substituent at the 4 position. 19F NMR chemical shifts for each conformer above the coalescence temperature were obtained by extrapolation from low temperature values, allowing the high precision determination of the equilibrium constants, and then the thermodynamic parameters (ΔG°, ΔH°, ΔS°). The validity of the hypothesis that substituent parameters are additive was discussed. Thermodynamic data of phenyl and cyclohexyl groups were also given.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.