Prediction of stability constants of Cu2+ complexes with organic fluorescent ligands using thermodynamic cycle in combination with DFT theory and SMD solvent model
Accurately predicting the stability constant ( ) of the Cu2+ complex with organic fluorescent ligands provides an important basis to design molecular fluorescent sensors for selective detection of Cu2+. With appropriate reference complexes, the calculated stability constants are in good agreement wi...
Main Authors: | Mai Van Bay, Nguyen Khoa Hien, Hoang Kim Thanh, Pham Cam Nam, Duong Tuan Quang |
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Format: | Article |
Language: | English |
Published: |
HUJOS
2020-11-01
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Series: | Tạp chí Khoa học Đại học Huế: Khoa học Tự nhiên |
Subjects: | |
Online Access: | http://jos.hueuni.edu.vn/index.php/HUJOS-NS/article/view/5947 |
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