Journal
TETRAHEDRON LETTERS
Volume 57, Issue 34, Pages 3853-3857Publisher
PERGAMON-ELSEVIER SCIENCE LTD
DOI: 10.1016/j.tetlet.2016.07.051
Keywords
Anion sensing; Photophysical; Computational; ESP properties
Categories
Funding
- DST [EMR/2014/001257]
- CSIR Govt. of India, New Delhi [011(2795)114/emr-II]
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Triarylborane substituted bisthiazole 1 was designed and synthesized by the Sonogashira cross-coupling reaction for selective detection of F- and CN- ions in the presence of Cl-, Br-, I- and NO2- anions. The detection limits for F- and CN- were found to be 5.7 x 10(-6) M and 2.1 x 10(-6) M, respectively. The time dependent density functional theory (TD-DFT) calculation at B3LYP on the bisthiazole triarylborane 1 was studied for F- and CN- ions. In the case of 1 Boron is electron deficient, the addition of F- ion should increase the electron density on Boron which was confirmed by electrostatic potential surfaces of bisthiazole triarylborane dyad 1, 1-F. (C) 2016 Elsevier Ltd. All rights reserved.
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