化学
席夫碱
滴定法
检出限
色酮
水溶液中的金属离子
部分
荧光
质子核磁共振
结合常数
化学计量学
碳-13核磁共振
离子
傅里叶变换红外光谱
分析化学(期刊)
无机化学
物理化学
立体化学
色谱法
有机化学
结合位点
生物化学
物理
量子力学
作者
Nisha Tomer,Rajesh Malhotra
标识
DOI:10.1016/j.molstruc.2021.132124
摘要
A new Schiff base 5-[(4-Oxo-4H-chromen-3-ylmethylene)-amino]-1H-pyrimidine-2, 4‑dione (CUR) was synthesized from chromone moiety and identified as a colorimetric as well as a fluorescent probe for Zn2+ ions detection. Characterization of CUR was done by utilizing 1H NMR, 13C NMR, FTIR, and HRMS analytical techniques. UV–Vis absorption and fluorescence studies revealed that this probe CUR offered great selectivity and sensitivity towards Zn2+ ions above other added metal ions, namely; Cd2+, Hg2+, Ag+, Zr2+, Cr3+, Cu2+, Mn2+, Fe3+, Ni2+, Co2+, Al3+, and Pb2+. A 2:1 binding stoichiometry among CUR and Zn2+ ions was obtained using Job's plot analysis and further confirmed by 1H NMR titrations, and HRMS parameters. The binding constant (Ka) and limit of detection (LOD) for Zn2+ ions were measured to be 7.7 × 106 M−1 and 9.6 × 10−9 M, respectively, using fluorimetric titrations with the help of the Benesi-Hildebrand equation (B-H equation). DFT computational studies also validated the results obtained from absorption and emission studies. The pH and time response studies ensured the stability of CUR and additionally, it was effectively implemented to quantify Zn2+ ions in the collected real water samples.
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