Insight into the Reaction Mechanism of α‐Amino Phosphonate Synthesis Using Succinic Acid as a Catalyst: Computational Kinetic Approach

作者：Sayyed Mostafa Habibi‐Khorassani; Mehdi Shahraki; Halimeh Yaghoubian

来源：Journal of the Chinese Chemical Society, 2017, 64(2): 195-204.

DOI：10.1002/jccs.201600765

• Kinetics
• Computational Method
• α‐Amino phosphonate
• Benzaldehyde

The reaction mechanism in the synthesis of particular α‐amino phosphonates from 4‐methyl benzaldehyde, aniline, and trimethyl phosphite in the presence of succinic acid is theoretically investigated. The profile of the potential energy surface is constructed at both HF /6‐31 + G(d,p) and B3LYP /6‐31...