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The hindered rotations of acetone were studied density functional theory (B3LYP) and second order Møller-Plesset approaches using 6-31G** and 6-311G** basis sets. One of the CH(3) groups of acetone with fixed heavy atoms was rotated from 0.0 to 120 degrees, and CCH angles were scanned from 90.3 to 130.3 degrees to cover the potential energy surface of(More)
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