Silver(I)-selective electrodes based on rare earth element double-decker porphyrins

Various double-decker porphyrins accommodating rare earth elements (Sm, Tb, Y) were investigated as ionophores in potentiometric ion sensors. The studied ion-selective electrodes based on double-decker porphyrins were primarily selective to Ag ions. The experimentally derived selectivity coefficien...

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Main Authors: Joon, Narender Kumar, Barnsley, Jonathan E., Ding, Ruiyu, Lee, Sunri, Latonen, Rose-Marie, Bobacka, Johan, Gordon, Keith C., Ogawa, Takuji, Lisak, Grzegorz
Other Authors: School of Civil and Environmental Engineering
Format: Journal Article
Language:English
Published: 2021
Subjects:
Online Access:https://hdl.handle.net/10356/149254
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author Joon, Narender Kumar
Barnsley, Jonathan E.
Ding, Ruiyu
Lee, Sunri
Latonen, Rose-Marie
Bobacka, Johan
Gordon, Keith C.
Ogawa, Takuji
Lisak, Grzegorz
author2 School of Civil and Environmental Engineering
author_facet School of Civil and Environmental Engineering
Joon, Narender Kumar
Barnsley, Jonathan E.
Ding, Ruiyu
Lee, Sunri
Latonen, Rose-Marie
Bobacka, Johan
Gordon, Keith C.
Ogawa, Takuji
Lisak, Grzegorz
author_sort Joon, Narender Kumar
collection NTU
description Various double-decker porphyrins accommodating rare earth elements (Sm, Tb, Y) were investigated as ionophores in potentiometric ion sensors. The studied ion-selective electrodes based on double-decker porphyrins were primarily selective to Ag ions. The experimentally derived selectivity coefficients were compared to theoretical predictions based on density functional theory (DFT) calculations of the metal-binding energies (ΔE) of double-decker porphyrin-metal ion complexes. Although DFT calculations were performed in vacuo, without taking into account ion-solvent and ion-membrane interactions, this computational approach showed relatively good correlation with the experimentally observed selectivity patterns of the ion-selective electrodes. Thus, DFT calculations were found to be a useful predictive tool when designing new ionophores for ion-selective electrodes.
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spelling ntu-10356/1492542021-06-04T02:00:44Z Silver(I)-selective electrodes based on rare earth element double-decker porphyrins Joon, Narender Kumar Barnsley, Jonathan E. Ding, Ruiyu Lee, Sunri Latonen, Rose-Marie Bobacka, Johan Gordon, Keith C. Ogawa, Takuji Lisak, Grzegorz School of Civil and Environmental Engineering Nanyang Environment and Water Research Institute Science::Chemistry Ion-selective Electrode Double-decker Porphyrins Various double-decker porphyrins accommodating rare earth elements (Sm, Tb, Y) were investigated as ionophores in potentiometric ion sensors. The studied ion-selective electrodes based on double-decker porphyrins were primarily selective to Ag ions. The experimentally derived selectivity coefficients were compared to theoretical predictions based on density functional theory (DFT) calculations of the metal-binding energies (ΔE) of double-decker porphyrin-metal ion complexes. Although DFT calculations were performed in vacuo, without taking into account ion-solvent and ion-membrane interactions, this computational approach showed relatively good correlation with the experimentally observed selectivity patterns of the ion-selective electrodes. Thus, DFT calculations were found to be a useful predictive tool when designing new ionophores for ion-selective electrodes. Accepted version 2021-06-04T01:45:08Z 2021-06-04T01:45:08Z 2020 Journal Article Joon, N. K., Barnsley, J. E., Ding, R., Lee, S., Latonen, R., Bobacka, J., Gordon, K. C., Ogawa, T. & Lisak, G. (2020). Silver(I)-selective electrodes based on rare earth element double-decker porphyrins. Sensors and Actuators B: Chemical, 305, 127311-. https://dx.doi.org/10.1016/j.snb.2019.127311 0925-4005 0000-0002-8378-0991 0000-0003-2346-9947 0000-0003-2833-6166 https://hdl.handle.net/10356/149254 10.1016/j.snb.2019.127311 2-s2.0-85075866001 305 127311 en Sensors and Actuators B: Chemical © 2019 Elsevier B.V. All rights reserved. This paper was published in Sensors and Actuators B: Chemical and is made available with permission of Elsevier B.V. application/pdf
spellingShingle Science::Chemistry
Ion-selective Electrode
Double-decker Porphyrins
Joon, Narender Kumar
Barnsley, Jonathan E.
Ding, Ruiyu
Lee, Sunri
Latonen, Rose-Marie
Bobacka, Johan
Gordon, Keith C.
Ogawa, Takuji
Lisak, Grzegorz
Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title_full Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title_fullStr Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title_full_unstemmed Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title_short Silver(I)-selective electrodes based on rare earth element double-decker porphyrins
title_sort silver i selective electrodes based on rare earth element double decker porphyrins
topic Science::Chemistry
Ion-selective Electrode
Double-decker Porphyrins
url https://hdl.handle.net/10356/149254
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