Publications
Publications
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2025
Pyrrolo[1,2-a] Quinoxaline: A Combined Experimental and Computational Study on the Photophysical Properties of a New Photofunctional Building Block
Shukla, A. K.; Choudhary, S.; Sisodiya, D. S.; Mahale, A.; Vipparthi, P.; Togiti, U. K.; Kulkarni, O. P.; Chattopadhyay, A.; Bhattacharya, A.
Journal of Physical Chemistry B (2025)
DOI
Theoretical Study of Spectroscopy and Photodynamics of Decatetraene as a Representative Dimethylated Polyene
Chattopadhyay, A.; Menger, M. F. S. J.; Sisodiya, D. S.; Köppel, H.
Journal of Physical Chemistry A, 129 (10), 2442-2453 (2025)
Article
2024
The Photochemical Trans → Cis and Thermal Cis → Trans Isomerization Pathways of Azobenzo-13-Crown Ether: A Computational Study on a Strained Cyclic Azobenzene System
Sisodiya, D. S.; Chattopadhyay, A.
Journal of Chemical Physics, 161 (3), 034307 (2024)
DOI
2023
To Quench or Not: Extending a β-Carboline Fluorophore for TNT Detection in Aqueous Media via Simultaneous ESPT Destabilization and AIE
Shukla, A. K.; Sisodiya, D. S.; Savita; Chattopadhyay, A.; Bhattacharya, A.
Journal of Physical Chemistry B, 127 (46), 10025-10034 (2023)
DOI
Unexplored Isomerization Pathways of Azobis (Benzo-15-Crown-5): Computational Studies on a Butterfly Crown Ether
Sisodiya, D. S.; Ali, S. M.; Chattopadhyay, A.
Journal of Physical Chemistry A, 127 (34), 7080-7093 (2023)
DOI
A DFT Study on the Reaction Pathway Involved in the Metal-Ion-Templated Synthesis of Benzo-21-Crown-7 (B21C7) from Catechol and Hexaethylene Glycol Ditosylate in the Presence of Base
Sisodiya, D. S.; Ali, S. M.; Chattopadhyay, A.
Journal of Physical Organic Chemistry, 36 (3), e4471 (2023)
DOI
2022
Revealing the Unexplored Mechanism of Photochemical Oxaziridine Conversion Process of 2H-Imidazole 1-Oxides
Sen, S.; Sisodiya, D. S.; Nikam, R.; Chattopadhyay, A.
ChemistrySelect, 7 (41), e202202371 (2022)
DOI
The Mechanism of Photoconversion of Cyclic Dinitrone to Oxaziridine and Dioxaziridine: A Computational Investigation of an Experimentally Reported Photochemical Reaction
Sen, S.; Sisodiya, D. S.; Chattopadhyay, A.
Journal of Physical Organic Chemistry, 35 (4), e4310 (2022)
DOI
Exploring the Reaction Pathway Involved in the Dibenzo-18-Crown-6 Synthesis from Catechol and Bis(2-Chloroethyl) Ether in Presence of Base
Sisodiya, D. S.; Ali, S. M.; Chattopadhyay, A.
Journal of Physical Organic Chemistry, 35 (3), e4309 (2022)
DOI
A Combination of a Graphene Quantum Dots-Cationic Red Dye Donor-Acceptor Pair and Cucurbit[7]Uril as a Supramolecular Sensor for Ultrasensitive Detection of Cancer Biomarkers Spermine and Spermidine
Bhosle, A. A.; Banerjee, M.; Hiremath, S. D.; Sisodiya, D. S.; Naik, V. G.; Barooah, N.; Bhasikuttan, A. C.; Chattopadhyay, A.; Chatterjee, A.
Journal of Materials Chemistry B, 10 (40), 8258-8273 (2022)
DOI
2020
Synthesis of Green Emitting Multi-Substituted Dibenzodioxins and Related Heteroacenes and Computational Investigation of Substituent Effects on Emission Spectra
Ashok Phadte, A.; Chattopadhyay, A.; Banerjee, S.; Singh Sisodiya, D.; Raghava, T.
ChemistrySelect, 5 (33), 10177-10186 (2020)
DOI