An ab initio study of the chemical bond and the 129Xe NMR chemical shifts in M+ −Xe compounds, M = Li, Na, K, Cu, Ag

Ab initio study of the 13C NMR chemical

Ab initio study of the 13C NMR chemical shifts for some polyene compounds as models for the chromophore of rhodopsin

✍ M. Wada; M. Sakurai; Y. Inoue; R. Chûjô 📂 Article 📅 1992 🏛 John Wiley and Sons 🌐 English ⚖ 513 KB

## Abstract __Ab initio__ NMR shieldings, based on the Hansen and Bouman theory, were calculated for some polyene compounds in order to apply the method to retinal proteins. It is shown that the __ab initio__ results reproduce well the magnetic properties peculiar to the polyene ^13^C chemical shif