FT-IR, FT-Raman, UV–Visible, NMR, DFT and molecular docking investigation of 1-(phenyl (piperidin-1-yl) methyl) naphthalene-2-ol

Autor: P. Rajamani, V. Vijayakumar, N. Sundaraganesan, Mani Jeeva, Maria Susai Boobalan

Publikováno v: Results in Chemistry, Vol 3, Iss , Pp 100096- (2021)

1-(Phenyl(piperidin-1-yl)methyl)naphthalene-2-ol was synthesized and characterized utilizing spectroscopic techniques (FT-IR, FT-Raman, UV–Visible, NMR, Mass and CHNS analysis). The synthesized compound chemical structure was optimized using the De

Externí odkaz: https://doaj.org/article/fa01b08bbe94489caad9466b3ee2bf34

List of contributors

Autor: Nidhi Agnihotri, R. Anantharaj, K.A. Anju, Umaiyambika Neduvel Annal, Kirtikumar C. Badgujar, Vivek C. Badgujar, Sholinghur Asuri Bhakthochidan, Bhalchandra M. Bhanage, Maria Susai Boobalan, Elsa Cherian, S. Chozhavendhan, Pinaki Dey, Pritam Dey, Bijay Dhakal, V. Dhithya, Kevin Joseph Dilip, K. Divakar, Kaleab Bizuneh Gebeyehu, Jenet George, Manjot Gill, D. Gnana Prakash, Edgard Gnansounou, K. Gomathi, B. Gopalakrishnan, M. Gopinath, Bhargavi Gunturu, Geetika Gupta, Baskar Gurunathan, Adam Shahul Hameed, Jeehoon Han, J. Iyyappan, Samuel Jacob, Mani Jayakumar, G. Kalavathy, V. Kanishka, Natchimuthu Karmegam, S. Karthikadevi, Ilango Karuppasamy, A. Kaviprabha, R. Kheerthivasan, Chandraraj Krishnan, Amit Kumar, Selvakumar Kuppusamy Vaithilingam, Vinoj Kurian, Ratna Dewi Kusumaningtyas, Ririn Mahmudati, Prasad Mandade, Vijay Mani, Shyam Kumar Masakapalli, Samir Meramo, Bishwambhar Mishra, Lakshmi Mohan, Upasana Mohanty, Monoj Kumar Mondal, A. Muthu Kumara Pandian, Praveena Nagarajan, E. Nakkeeran, Arunodhaya Natarajan, Jayato Nayak, Yogesh M. Nimdeo, Louis Anto Nirmal, Ashok Pandey, Sivakumar Pandian, Senthil Kumar Ponnusamy, Haniif Prasetiawan, S. Prathiba, A. Priyanka, Indah Purnamasari, G.B. Radhika, Gobinath Rajagopalan, M. Rajamehala, Y. Rajasri, Naveenkumar Rajendran, Geethalakshmi Ramakrishnan, P. Ramesh, Panneerselvam Ranganathan, Abiram Karanam Rathankumar, Srimanta Ray, C. Nagendranatha Reddy, Veeraraghavan Babulu Roshini, Renganathan Sahadevan, Kongkona Saikia, P. Saranya, Priyanka Saravanan, Anna Shaji, A. Shalini, Nadeem Siddiqui, G. Srinivas, T. Srinivas, Renugaa Su, V. Swapna, Jyotika Thakur, Vinoth Kumar Vaidyanathan, A. Vaishnavi, M. Vichitra, M. Vijay Pradhap Singh, Y. Vineetha, Ravichandran Vishal, Kailas L. Wasewar, E. Yuvanashree

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::df69d82d11f86d9ea3a32a07beb10b0f
https://doi.org/10.1016/b978-0-323-90040-9.00005-9

Spectral (FT-IR, FT-Raman, NMR, UV–vis), electronic structure (DFT, TD-DFT), and molecular docking investigations on 1-((1H-benzo[d]imidazol-1-yl)methyl)urea – A bioactive Mannich base system

Autor: M Sumithra, Susairaj Jone Pradeepa, D Tamilvendan, Maria Susai Boobalan, N Sundaraganesan

Publikováno v: Chemical Physics Letters. 806:140047

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::94c41518261c4a2a3561a5f41da5f9b4
https://doi.org/10.1016/j.cplett.2022.140047

Synthesis, spectroscopic, computational and molecular docking studies of 1-(pyridin-2-yl amino)methyl napthalene-2-ol

Autor: Mani Jeeva, V. Vijayakumar, P. Rajamani, Maria Susai Boobalan, N. Sundaraganesan

Publikováno v: Journal of Molecular Structure. 1197:417-429

A simple Mannich condensation reaction furnished 1-(pyridin-2-yl amino)methyl napthalene-2-ol using 2-aminopyridine, naphthalene-2-ol and formaldehyde as starting materials. Then, a complete spectroscopic documentation of synthesized compound was car

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::ead239bbd35fdf0789a0f971c9722270
https://doi.org/10.1016/j.molstruc.2019.07.040

Are vinyl coupled furan derivatives better than vinyl coupled thiophene derivatives for optoelectronic applications? – Answers from DFT/TDDFT calculations

Autor: Venkatachalam Tamilmani, Maria Susai Boobalan, Rajadurai Vijay Solomon, Duraikannu Gajalakshmi

Publikováno v: Computational Materials Science. 162:60-68

In the present study, twenty three new vinyl coupled furan oligomers (VCFOs) and four already reported thiophene oligomer (VCTOs) have been investigated for potential optoelectronic properties using DFT/TDDFT calculations. Frontier molecular orbital

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::236c821ad5638a148aed27bf06a9f091
https://doi.org/10.1016/j.commatsci.2019.02.015