摘要
The rotational profiles of 2-methoxypropanal and 2-N,N-dimethyl-aminopropanal are theoretically predicted using ab initio methods at the MP2/6-31G*//3-21G level of theory. The conformational energies show a strong dependence on the torsion angle not only around the CC bond but also around the CR (ROMe, NMe2) bond.
源语言 | 英语 |
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页(从-至) | 3971-3982 |
页数 | 12 |
期刊 | Tetrahedron |
卷 | 49 |
期 | 19 |
DOI | |
出版状态 | 已出版 - 7 5月 1993 |
已对外发布 | 是 |