The 100th CSJ Annual Meeting

Presentation information

Academic Program (AP)

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

Sun. Mar 22, 2020 1:40 PM - 6:00 PM E2 (K402, Lecture Hall Bldg. [4F])

1E2-29~1E2-33 NAKAI, Hiromi
1E2-36~1E2-40 TAKAHASHI, Satoshi
1E2-42~1E2-46 KISHIMOTO, Naoki
1E2-49~1E2-53 SHIGETA, Yasuteru

3:10 PM - 3:20 PM

[1E2-38] Theoretical study on the metal cation effects on α-acid isomerization

Oral A

○KIMURA, Minami; HIGASHI, Masahiro; SATO, Hirofumi (Sch. Eng., Kyoto Univ.)

PC Setting Time: 14:40-14:50

Keywords:Metal cation effects, Solvation effects, Alpha-acids, Quantum chemical calculation

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