In the present work, we studied the selective chemosensing behavior of 2- hydroxyacetophenone nicotinic acid hydrazone (H2L) with fluoride anion. Theoretical and experimental tools were deployed to understand the mechanism of sensing. Experimentally, upon the addition of fluoride to H2L, a change in colour was observed. The 1H NMR spectral studies showed a change in electronic environment around the N-H and O-H bonding sites of the receptor. UV visible spectrum confirmed the formation of a new complex and IR spectrum showed the absence of the hydrogen bond donor peaks. Density Functional Theory (DFT) calculations were carried out in ground state and they were found to be in accordance with the experimental results.
Published in | International Journal of Computational and Theoretical Chemistry (Volume 7, Issue 1) |
DOI | 10.11648/j.ijctc.20190701.15 |
Page(s) | 28-34 |
Creative Commons |
This is an Open Access article, distributed under the terms of the Creative Commons Attribution 4.0 International License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted use, distribution and reproduction in any medium or format, provided the original work is properly cited. |
Copyright |
Copyright © The Author(s), 2019. Published by Science Publishing Group |
Colorimetric Sensor, IR Sensing, Fluoride Anion Recognition, Hydrogen Bonding, DFT Calculations, Acoyl Hydrazones
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APA Style
Noorain Khalifa, Shibin Jasper Thomas, Nithin Kota Vasudeva Upadhya, Sreeja Puthenveettil Balakrishnan. (2019). Investigation of 2-Hydroxyacetophenone Nicotinic Acid Hydrazone as a Fluoride Sensor. International Journal of Computational and Theoretical Chemistry, 7(1), 28-34. https://doi.org/10.11648/j.ijctc.20190701.15
ACS Style
Noorain Khalifa; Shibin Jasper Thomas; Nithin Kota Vasudeva Upadhya; Sreeja Puthenveettil Balakrishnan. Investigation of 2-Hydroxyacetophenone Nicotinic Acid Hydrazone as a Fluoride Sensor. Int. J. Comput. Theor. Chem. 2019, 7(1), 28-34. doi: 10.11648/j.ijctc.20190701.15
AMA Style
Noorain Khalifa, Shibin Jasper Thomas, Nithin Kota Vasudeva Upadhya, Sreeja Puthenveettil Balakrishnan. Investigation of 2-Hydroxyacetophenone Nicotinic Acid Hydrazone as a Fluoride Sensor. Int J Comput Theor Chem. 2019;7(1):28-34. doi: 10.11648/j.ijctc.20190701.15
@article{10.11648/j.ijctc.20190701.15, author = {Noorain Khalifa and Shibin Jasper Thomas and Nithin Kota Vasudeva Upadhya and Sreeja Puthenveettil Balakrishnan}, title = {Investigation of 2-Hydroxyacetophenone Nicotinic Acid Hydrazone as a Fluoride Sensor}, journal = {International Journal of Computational and Theoretical Chemistry}, volume = {7}, number = {1}, pages = {28-34}, doi = {10.11648/j.ijctc.20190701.15}, url = {https://doi.org/10.11648/j.ijctc.20190701.15}, eprint = {https://article.sciencepublishinggroup.com/pdf/10.11648.j.ijctc.20190701.15}, abstract = {In the present work, we studied the selective chemosensing behavior of 2- hydroxyacetophenone nicotinic acid hydrazone (H2L) with fluoride anion. Theoretical and experimental tools were deployed to understand the mechanism of sensing. Experimentally, upon the addition of fluoride to H2L, a change in colour was observed. The 1H NMR spectral studies showed a change in electronic environment around the N-H and O-H bonding sites of the receptor. UV visible spectrum confirmed the formation of a new complex and IR spectrum showed the absence of the hydrogen bond donor peaks. Density Functional Theory (DFT) calculations were carried out in ground state and they were found to be in accordance with the experimental results.}, year = {2019} }
TY - JOUR T1 - Investigation of 2-Hydroxyacetophenone Nicotinic Acid Hydrazone as a Fluoride Sensor AU - Noorain Khalifa AU - Shibin Jasper Thomas AU - Nithin Kota Vasudeva Upadhya AU - Sreeja Puthenveettil Balakrishnan Y1 - 2019/03/25 PY - 2019 N1 - https://doi.org/10.11648/j.ijctc.20190701.15 DO - 10.11648/j.ijctc.20190701.15 T2 - International Journal of Computational and Theoretical Chemistry JF - International Journal of Computational and Theoretical Chemistry JO - International Journal of Computational and Theoretical Chemistry SP - 28 EP - 34 PB - Science Publishing Group SN - 2376-7308 UR - https://doi.org/10.11648/j.ijctc.20190701.15 AB - In the present work, we studied the selective chemosensing behavior of 2- hydroxyacetophenone nicotinic acid hydrazone (H2L) with fluoride anion. Theoretical and experimental tools were deployed to understand the mechanism of sensing. Experimentally, upon the addition of fluoride to H2L, a change in colour was observed. The 1H NMR spectral studies showed a change in electronic environment around the N-H and O-H bonding sites of the receptor. UV visible spectrum confirmed the formation of a new complex and IR spectrum showed the absence of the hydrogen bond donor peaks. Density Functional Theory (DFT) calculations were carried out in ground state and they were found to be in accordance with the experimental results. VL - 7 IS - 1 ER -