【作者】Rui-Ping Huo, Xiang Zhang, Kai-Xin Xie, Cai-Feng Zhang, Meng-Yao Li
【刊名】The journal of physical chemistry. A
【作者单位】Affiliations 1 College of Chemistry and Materials, Taiyuan Normal University, Jinzhong 030619, China. 2 Key Laboratory of Magnetic Molecules & Magnetic Information Materials Ministry of Education, The School of Chemical and Material Science, Shanxi Normal University, Taiyuan 030600, China.
【年份】2025
【ISSN】1520-5215
【摘要】 The mechanistic details of the DABCO-catalyzed diastereoselective cyclization between β-alkyl nitroolefins and alkylidene malononitriles were elucidated by using dispersion-corrected density functional theory calculations at the M06-2X/6-311G level ...
