【作者单位】a Department of Chemistry, Taiyuan Normal University, Jinzhong, 030619, China; b Key Laboratory of Magnetic Molecules and Magnetic Information Materials Ministry of Education, School of Chemical and Material Science, Shanxi Normal University, Linfen, 041004, China; c Humic Acid Engineering and Technology Research Center of Shanxi Province, Jinzhong, 030619, China
【年份】2019
【卷号】Vol.123 No.47
【页码】10263-10272
【ISSN】1089-5639;1520-5215
【摘要】 The ruthenium-catalyzed α-alkylation reaction of arylmethyl nitriles using alcohols in toluene has been extensively investigated by means of SMD-M06-2X/6-311G-LANL2dz for other atoms) calculations. Detailed mechanistic schemes have been proposed a...
