Wesam Alramadeen, Yu Ding, et al.
IISE Transactions on Healthcare Systems Engineering
The prediction made by high level ab initio theory (MP4/6-311G* //MP2/6-311G*+ZPE) that the prop-2-yl cation prefers a twisted structured with C symmetry is supported by the excellent and unique correspondence of the experimental and individual Gauge for Localized molecular Orbitals (IGLO) calculated 13C n.m.r. chemical shifts for that conformation.
Wesam Alramadeen, Yu Ding, et al.
IISE Transactions on Healthcare Systems Engineering
Charles W. Bauschlicher Jr., Byron H. Lengsfield III, et al.
The Journal of Chemical Physics
Alexandre Andrade Loch, Ana Caroline Lopes-Rocha, et al.
JMIR Mental Health
Thomas Zimmerman, Neha Sharma, et al.
IJERPH