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Faculty Member Details

Staff Id : 03769
Name : Dr. N. SUNDARAGANESAN
Designation : PROFESSOR
Department : PHYSICS
Qualification : M.Sc.,M.Phil,Ph.D.,
Specialization : Molecular Spectroscopy & Quantum chemical Calculations, Band gap energy Calculations.
Date of Birth : 05-05-1965
Date of Joining : 01-09-1997

Present Address Contact Number E-Mail Address
Professor, Engineering Physics, FEAT,
Annamalai University,
Annamalainagar-608 002.		9442068405sundaraganesan@yahoo.com

Research Guidance
Discipline Awarded Guidance
M.Phil./M.E./M.Sc. 3636
Ph.D. 2828


Conference /Seminar / Symposia / Workshop
Conference Seminar Symposia Workshop
National International
Attended 1041022
Conducted -----


Research Projects
Major Projects Minor Projects Total Amount (Rs.)
Completed 11783000.00
Ongoing ---

Teaching and Research Experience Industry Experience
27 Years -

Journals Conference Books Published Popular Article
National International National International
23 127 - - - -

List of Publications - National
E.Kavitha, N. Sundaraganesan, S. Sebastian, "Molecular Structure, vibrational spectroscopic and HOMO, LUMO studies of 4-nitroaniline by density functional method.", Indian Journal of Pure & Applied Physics, Volume 48, Number 1, Jan 2010, pp. 20-30. 2010/.
.Chandra, H.Saleem, N. Sundaraganesan, "experimental and theoretical vibrational spectroscopic and HOMO-LUMO studies of 1,3-dimethylbarbituric acid.", Indian Journal of Chemistry, Volume 48A, Number 09, Sep 2009, pp. 1219-1227. 2009.
N. Sundaraganesan, B.D.Joshua, T.Radjakoumar, "Molecular structure and vibrational spectra of 2-chlorobenzoic acid by density functional theory and ab â,“initio Hartree-Fock calculations.", Indian Journal of Pure and Applied Physics, Volume 47, Number 1, Apr 2009, pp. 248-258. 2009.
N. Sundaraganesan, G. Elango, S. Sebastian, P. Subramani, "Molecular structure, Vibrational spectroscopic studies and analysis of 2-fluoro-5-methylbenzonitrile.", Indian Journal of Pure & Applied Physics, Volume 47, Number 1, Jul 2009, pp. 481-490. 2009.
H.Saleem, N. Sundaraganesan , "Vibrational spectra, assignments and normal coordinate analysis of 5-amino-2-nitrobenzoic acid.", Annamalai University Science Journal, Volume 44, Number 1, Jan 2008, pp. 55-64. 2008.
. Kalaichelvan, N. Sundaraganesan, B. Dominic Joshua, ", FT-IR, FT-Raman spectra and ab initio HF and DFT calculations of 2-nitro- and 4-nitrobenzaldehydes.", Indian Journal of Chemistry, Volume 47A, Number 1, Nov 2008, pp. 1623-1641. 2008.
N. Sundaraganesan, B. Dominic Joshua, C. Meganathan, S. Sebastian, "Vibrational spectroscopic studies supported by HF, DFT calculations of 2, 4, 6-triaminopyrimidine.", Indian Journal of Chemistry, Volume 47A, Number 1, Jun 2008, pp. 821-829. 2008.
P.K.Singh, T. Hasan, O.Prasad, L.Sinha, S.Jain, K.Raj, N. Sundaraganesan, N. Misra, "Vibrational analysis of deoxy-andrographolide using MM/QM methods, 2007, Spectroscopy.", Spectroscopy, Volume 21, Number 5-6, Jan 2007, pp. 272-292. 2007.
N. Sundaraganesan, B. Dominic Joshua, M. Rajamoorthy, C. H. Gangadhar, "FT-IR, FT-Raman spectra and ab initio DFT vibrational analysis of 2-chloro-5-aminopyridine.", Indian Journal of Pure and Applied Physics, Volume 45, Number 1, Dec 2007, pp. 969-978. 2007.
N. Sundaraganesan, H.Saleem, "FT-Raman, FT-IR, spectra and Normal coordinate analysis of 4-amino-3- bromopyridine, .", Annamalai University Science Journal, Volume 43, Number 1, Jan 2006, pp. 149-160. 2006.
N. Sundaraganesan, C. Meganathan, B. Anand, M. Ramalingam, C. Lapouge, ". FT-Raman and FT-IR spectra, vibrational assignments and density functional studies of p-bromophenoxy acetic acid.", International Conference on spectro-physics, Volume 1, Number 1, Feb 2005, pp. 1-1. 2005.
N. Sundaraganesan, S.Ilakiamani, H.Saleem, S.Mohan, , "FT-Raman, FTIR spectra and normal coordinate analysis of 5-bromo-2-nitropyridine.", Indian journal of pure and Applied physics,, Volume 42, Number 8, Jan 2004, pp. 585-590. 2004.
N Sundaraganesan, H.Saleem, S. Mohan, "FT-IR, FT-Raman spectra of 2-amino-5-bromobenzoic acid.", Indian J.Phys, Volume 78, Number 6, Jan 2004, pp. 489-494. 2004.
N. Sundaraganesan, H.Saleem, S.Mohan, "FT-IR, FT-Raman spectra of 2-amino-5- brobenzoic acid.", Indian J.Phys, Volume 78, Number 6, Jan 2004, pp. 489-494. 2004.
M Geetha, R Govindan, S Manimegalai, K Velmurugan, N Sundaraganesan, J Karpagam, S Sebastian, ", Quantum mechanical studies of the structure-activity relationship and electronic vibration of some dietary flavonoids.", Journal of Applied Sciences, Volume 16, Number 11, Jan 2000, pp. 424-425. 2000.
N Sundaraganesan, S Mohan, "Vibrational Spectra and Normal Coordinate Analysis of N-Methylthiopropionamide.", Indian J. Phys, Volume 6 8, Number 1, Jan 1994, pp. 87-91. 1994.
S Mohan, N Sundaraganesan, , "Infrared-Spectrum And Normal-Coordinate Calculations Of Deuterated Acrylamide.", Arabian Journal For Science And Engineering , Volume 17, Number 4 A, Jan 1993, pp. 497-504. 1993.
S Mohan, N Sundaraganesan, "Vibrational Spectra of Meta-Nitrobenzophenone.", Indian National Science Academy , Volume 58A, Number 58, Jan 1992, pp. 151-151. 1992.
S Mohan, N Sundaraganesan , "Vibrational Spectra of Meta-Nitrobenzophenone.", Proceedings-Indian National Science Academy , Volume PART A , Number 58, Jan 1992, pp. 151-151. 1992.
S Mohan, N Sundaraganesan , "Laser Raman and Infrared Spectra of 6-Amino-M-Cresol.", Indian Journal of Physics , Volume 66 B, Number 2, Jan 1992, pp. 213-219. 1992.
S Mohan, N Sundaraganesan , "Laser Raman and Infrared Spectra of 6-Amino-M-Cresol.", Indian Journal of Physics , Volume 66 B, Number 2, Jan 1992, pp. 213-219. 1992.
S Mohan, N Sundaraganesan, "Vibrational spectra and analysis of 2, 4, 6-triaminopyrimidine.", Indian journal of pure & applied physics , Volume 29, Number 1, Jan 1991, pp. 807-810. 1991.
S Mohan, N Sundaraganesan, "Vibrational-Spectra, Assignments And Normal Coordinate Analysis Of N-Methylacetamide,.", Arabian Journal For Science And Engineering , Volume 16, Number 2 A, Jan 1991, pp. 159-165. 1991.
List of Publications - International
S Sebastian , S Sylvestre , N Sundaraganesan , B Karthikeyan , S Silvan , "Conformational analysis, molecular structure, spectroscopic, NBO, reactivity descriptors, wavefunction and molecular docking investigations of 5,6-dimethoxy-1-indanone: A potential anti Alzheimer's agent.", Heliyon ., Volume 2022 Jan 23;8(1):e08821, Number 2022 Jan 23;8(1):e08821, Jan 2022, pp. 1-1. 2022/10.1016/j.heliyon.2022.e08821.
Krishnan SarojiniDeviaPalaniappanSubramanibNamadevanSundaraganesancManiJeevadSusairaj JonePradeepacBalakrishnanKarthikeyane, "Synthesis, spectra, electronic structure, molecular docking and cytotoxicity investigation on 2-(piperidin-1-ylmethyl)-isoindoline-1,3-dione â,“ A Mannich base system.", Journal of Molecular Structur, Volume 1224, Number 1, Jan 2021, pp. 129151-129151. 10.1016/j.molstruc.2020..
P Rajamani, V Vijayakumar, N Sundaraganesan, M Jeeva, MS Boobalan, ", FT-IR, FT-Raman, UVâ,“Visible, NMR, DFT and molecular docking investigation of 1-(phenyl (piperidin-1-yl) methyl) naphthalene-2-ol .", Journal of Results in Chemistry, Volume 3, Number 1, Jan 2021, pp. 100096-100096. 2021/10.1016/j.rechem.2021.100096.
KS Devi, P Subramani, N Sundaraganesan, M Jeeva, SJ Pradeepa, "Synthesis, spectra, electronic structure, molecular docking and cytotoxicity investigation on 2-(piperidin-1-ylmethyl)-isoindoline-1, 3-dioneâ,“A Mannich base system.", Journal of Molecular Structure, Volume 1224, Number 1, Jan 2021, pp. 129151-129151. 2021/10.1016/j.molstruc.2020.129151.
P Rajamani, V Vijayakumar, P Nagaraaj, N Sundaraganesan, "Synthesis, Characterization, Spectroscopic, DFT and Molecular Docking Studies of 3-(3, 4-Dihydroxyphenyl)-1-Phenyl-3-(Phenylamino) Propan-1-One.", Journal of Polycyclic Aromatic Compounds(, Volume 1, Number 1, Oct 2020, pp. 1-1. 10.1080/10406638.2020.1837190.
K.Sarojinidevi, P.Subramani, N.Sundaraganesan, MariaSusaiBoobalan,Tamilvendan, "Investigation on spectra (UVâ,“Vis, vibrational, NMR, HRMS), electronic structure (DFT calculations), molecular docking and antidiabetic activity of N-((benzo[d]thiazol-2-ylthio)methyl)-N-cyclohexylcyclohexanamine â,“ A Mannich base.", Journal of Molecular Structure, Volume 1219, Number 1, Nov 2020, pp. 128604-128604. 2020/10.1016/j.molstruc.2020.128604.
P. Rajamani, N. Sundaraganesan, V. Vijayakumar, M.S. Boobalan, M. Jeeva, ", Synthesis, spectroscopic, computational and molecular docking studies of 1-(pyridin-2-yl amino)methyl napthalene-2-ol,.", Journal of Molecular Structure, Volume 1219, Number 1, Nov 2020, pp. 128604-128604. 2020/10.1016/j.molstruc.2020.128604.
K.Sarojinidevi, P.Subramani, ManiJeeva, N.Sundaraganesan, MariaSusaiBoobalan, "Synthesis, molecular structure, quantum chemical analysis, spectroscopic and molecular docking studies of N-(Morpholinomethyl) succinimide using DFT method.", Journal of Molecular Structure, Volume 1175, Number 1, Jan 2019, pp. 609-623. 2019/10.1016/j.molstruc.2018.07.101.
G. Shakila, H. Saleem, N. Sundaraganesan , "FT-IR, FT-Raman, NMR and U-V Spectral investigation: Computation of vibrational frequency, chemical shifts and electronic structure calculations of 1-bromo-4-nitrobenzene.", World Scientific News, Volume 61, Number 2, Nov 2017, pp. 146-181. 2017/.
S.JonePradeepa, Maria,SusaiBoobalan,D.Tamilvendan, N.Sundaraganesan, S.Sebastian, KunQian, "Spectra, electronic structure and molecular docking investigations on 3-(phenyl(p-tolylamino)methyl)naphthalen-2-ol â,“ An experimental and computational approach.", Journal of Molecular Structure, Volume 1135, Number 1, May 2017, pp. 53-66. 2017/10.1016/j.molstruc.2017.01.020.
S. Jone Pradeepa, D. Tamilvendan, Maria Susai Boobalan, N. Sundaraganesan, "Vibrational and structural observations upon 3-((1H-benzo[d]imidazol-1-yl)methyl)naphthalen-2-ol from spectral and DFT computing approaches.", Journal of Molecular Structure, Volume 1112, Number 1, May 2016, pp. 33-44. 2016/10.1016/j.molstruc.2016.01.026.
M. Kurt, E. Babur Sas, M. Can, S. Okur, S. Icli, S. Demic, M. Karabacak,N. Sundaraganesan, T. Jayavarthanan, "Synthesis and spectroscopic characterization on 4-(2,5-di-2-thienyl1H-pyrrol-1-yl)benzoic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 152, Number 1, Jan 2016, pp. 8-17. 2016/10.1016/j.saa.2015.07.058.
G. Mariappan, N. Sundaraganesan, "Structural and vibrational spectroscopic analysis of anticancer drug mitotane using density functional theory,.", ScienceDirect, Proceedings , Volume 2, Number 3, Jun 2015, pp. 965-968. 2015/doi.org/10.1016/j.matpr.2015.06.017.
S.P. Vijayachamundeeswari, B. Yagna Narayana, S. Jone Pradeepa, N. Sundaraganesan, "Vibrational analysis, NBO analysis, NMR, UV-VIS, hyperpolarizability analysis of Trimethadione by density functional theory.", Journal of Molecular Structure, Volume 1099, Number 1, Nov 2015, pp. 633-643. 2015/10.1016/j.molstruc.2015.06.079.
E.B. Sas, M. Kurt, M. Karabacak, A. Poiyamozhi, N. Sundaraganesan, "FT-IR, FT-Raman, dispersive Raman, NMR spectroscopic studies and NBO analysis of 2-Bromo-1H-Benzimidazol by density functional method,.", Journal of Molecular Structure, Volume 1081, Number 1, Feb 2015, pp. 506-518. 2015/10.1016/j.molstruc.2014.10.025.
K. Govindarasu, E. Kavitha, N. Sundaraganesan, M. Suresh, M. Syed Ali Padusha, , "Synthesis, structural and spectral analysis of(E)-Nâ,"-(4-Methoxybenzylidene)pyridine-3-carbohydrazide dihydrate by density functional theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 135, Number 1, Jan 2015, pp. 1123-1136. 2015/10.1016/j.saa.2014.08.014.
S. Jone Pradeepa, N. Sundaraganesan, "Spectroscopic and molecular structure investigations of 9-vinylcarbazole by DFT and ab initio method,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 136, Number Part B,, Feb 2015, pp. 690-699. 2015/10.1016/j.saa.2014.09.083.
G. Mariappan, N. Sundaraganesan, "FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra, molecular geometry, conformational stability and some molecular properties of 1-Bromo-2,3-dimethoxynaphthalene.", Journal of Molecular Structure, Volume 1074, Number 1, Sep 2014, pp. 51-61. 2014/10.1016/j.molstruc.2014.04.022.
K. Govindarasu, E. Kavitha, N. Sundaraganesan, "Synthesis, structural, spectral (FTIR, FT-Raman, UV, NMR), NBO and first order hyperpolarizability analysis of N-phenylbenzenesulfonamide by density functional theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 133, Number 1, Dec 2014, pp. 417-431. 2014/10.1016/j.saa.2014.06.040.
S. Jone Pradeepa, N. Sundaraganesan, "Spectral analysis, vibrational assignments, NBO analysis, NMR, UVâ,“Vis, hyperpolarizability analysis of 2-aminoï¬shuorene by Density Functional Theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 125, Number 1, May 2014, pp. 211-221. 2014/10.1016/j.saa.2014.01.093.
G. Mariappan, N. Sundaraganesan, "FT-IR, FT-Raman, NMR spectra, density functional computations of the vibrational assignments (for monomer and dimer) and molecular geometry of anticancer drug 7-amino-2-methylchromone.", Journal of Molecular Structure, Volume 1063, Number 1, Apr 2014, pp. 192-202. 2014/10.1016/j.molstruc.2014.01.064.
M. Karabacak, M. Cinar, M. Kurt, A. Poiyamozhi, N. Sundaraganesan, "The spectroscopic (FT-IR, FT-Raman, UV and NMR) first order hyperpolarizability and HOMOâ,“LUMO analysis of dansyl chloride.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 117, Number 1, Jan 2014, pp. 234-244. 2014/10.1016/j.saa.2013.07.095.
G. Mariappan, N. Sundaraganesan, "Spectral and structural studies of the anti-cancer drug Flutamide by density functional theoretical method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 117, Number 1, Jan 2014, pp. 604-613. 2014/10.1016/j.saa.2013.09.043.
.P. Vijaya Chamundeeswari, E. James Jebaseelan Samuel, N. Sundaraganesan, "Molecular structure, vibrational spectra, NMR and UV spectral analysis of sulfamethoxazole.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 118, Number 1, Jan 2014, pp. 1-10. 2014/10.1016/j.saa.2013.07.063.
Z. Cinar, M. Karabacak, M. Cinar , M. Kurt, P. Chinna babu, N. Sundaraganesan, "The infrared, Raman, NMR and UV spectra, ab initio calculations and spectral assignments of 2-amino-4-chloro-6-methoxypyrimidine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 116, Number 1, Dec 2013, pp. 451-459. 2013/10.1016/j.saa.2013.07.044.
, S. Sylvestre, K. Oudayakumar, T. Jayavarthanan, B. Karthikeyan&N. Sundaraganesan, "Molecular structure, vibrational spectra and first-order hyperpolarisability analysis of 2-amino-6-nitrobenzothiazole by DFT method.", , Journal: Molecular Simulation, Volume 39, Number 13, Jun 2013, pp. 1052-1064. 2013/10.1080/08927022.2013.794271.
M. Karabacak, M. Cinar, M. Kurt , P. Chinna babu, N. Sundaraganesan, "Experimental and theoretical FTIR and FT-Raman spectroscopic analysis of 1-pyrenecarboxylic acid, .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 114, Number 1, Oct 2013, pp. 509-519. 2013/10.1016/j.saa.2013.05.086.
S. Sudha, N. Sundaraganesan, K. Vanchinathan, K. Muthu, SP. Meenakshisundaram, "Spectroscopic (FTIR, FT-Raman, NMR and UV) and molecular structure investigations of 1,5-diphenylpenta-1,4-dien-3-one: A combined experimental and theoretical study.", Journal of Molecular Structure, Volume 1030, Number 1, Dec 2012, pp. 191-203. 2012/10.1016/j.molstruc.2012.04.030.
P. Chinna Babu, N. Sundaraganesan, S. Sudha, V. Aroulmoji, E. Murano, "Molecular structure and vibrational spectra of Irinotecan: A density functional theoretical study, .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 98, Number 1, Dec 2012, pp. 1-6. 2012/10.1016/j.saa.2012.08.005.
T. Jayavarthanan, N. Sundaraganesan, M. Karabacak, M. Cinar, M. Kurt , "Vibrational spectra, UV and NMR, first order hyperpolarizability and HOMOâ,“LUMO analysis of 2-amino-4-chloro-6-methylpyrimidine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 97, Number 1, Nov 2012, pp. 811-824. 2012/doi.org/10.1016/j.saa.2012.07.064.
G. Mariappan, N. Sundaraganesan, S. Manoharan , "Experimental and theoretical spectroscopic studies of anticancer drug rosmarinic acid using HF and density functional theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 97, Number 1, Nov 2012, pp. 340-351. 2012/10.1016/j.saa.2012.06.011.
S. P. Vijaya Chamundeeswari, E. James Jebaseelan Samuel & N. Sundaraganesan, "Molecular structure and spectroscopic (FT-IR, FT-Raman, 13C, 1H NMR and UV) studies of 3,4-dihydroxy-l-phenylalanine using density functional theory.", Molecular Simulation, Volume 38, Number 12, May 2012, pp. 987-1000. 2012/10.1080/08927022.2012.682279.
. Sylvestre, S. Sebastian, K. Oudayakumar, T. Jayavarthanan, N. Sundaraganesan, "Experimental (FT-IR, FT-Raman and UVâ,“Vis) spectra and theoretical DFT investigations of 2,3-diaminophenazine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 96, Number 1, Oct 2012, pp. 401-412. 2012/10.1016/j.saa.2012.05.047.
S. Sudha, N. Sundaraganesan, K. Vanchinathan, K. Muthu & S. P. Meenakshisundaram, "Spectroscopic (FTIR, FT-Raman, NMR and UV) and molecular structure investigations of 1,5-diphenylpenta-2,4-dien-1-one: a combined experimental and theoretical approach.", Journal: Molecular Simulation, Volume 39, Number 4, Oct 2012, pp. 330-349. 2012/10.1080/08927022.2012.727210.
G. Mariappan, N. Sundaraganesan, S. Manoharan, ", The spectroscopic properties of anticancer drug Apigenin investigated by using DFT calculations, FT-IR, FT-Raman and NMR analysis.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 95, Number 1, Sep 2012, pp. 86-99. 2012/10.1016/j.saa.2012.04.089.
A. Poiyamozhi, N. Sundaraganesan, M. Karabacak, O. Tanr"±verdi, M. Kurt, "The spectroscopic (FTIR, FT-Raman, UV and NMR), first-order hyperpolarizability and HOMOâ,“LUMO analysis of 4-amino-5-chloro-2-methoxybenzoic acid,.", Journal of Molecular Structure, Volume 1024, Number 1, Sep 2012, pp. 1-12. 2012/10.1016/j.molstruc.2012.05.008.
C. Meganathan, S.Sebastian, I.Srinivasan, Keun Woo Lee,Byoung Ryong Jeong, Halil Oturak e, S.Sudha, "Structural, Vibrational(FT-IR and FT-Raman) and UV-Vis spectral analysis of 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea by DFT method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 95, Number 1, Sep 2012, pp. 331-340. 2012/10.1016/j.saa.2012.03.084.
M. Kurt, M. Karabacak, S. Okur, S. Sayin, M. Yilmaz, N. Sundaraganesan, ",Synthesis, FT-IR, FT-Raman, dispersive Raman and NMR spectroscopic study of a host molecule which potential applications in sensor devices.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 94, Number 1, Aug 2012, pp. 126-133. 2012/10.1016/j.saa.2012.03.070.
M. Karabacak, M. Kurt, M. Cinar, S. Ayyappan, S. Sudha, N. Sundaraganesan, "The spectroscopic (FT-IR, FT-Raman, UV) and first order hyperpolarizability, HOMO and LUMO analysis of 3-aminobenzophenone by density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 92, Number 1, Jun 2012, pp. 356-376. 2012/10.1016/j.saa.2012.02.067.
Usha Rani, M. Karabacak, O. Tanr"±verdi, M. Kurt, N. , "The spectroscopic (FTIR, FT-Raman, NMR and UV), first-order hyperpolarizability and HOMOâ,“LUMO analysis of methylboronic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 92, Number 1, Jun 2012, pp. 67-77. 2012/0.1016/j.saa.2012.02.036.
N. Dâ,"Amelio, V. Aroulmoji, A. Toraldo, N. Sundaraganesan, P.M. Anbarasan, "Aggregation properties and structural studies of anticancer drug Irinotecan in DMSO solution based on NMR measurements.", Journal of Molecular Structure, Volume 1013, Number 1, Apr 2012, pp. 26-35. 2012/10.1016/j.molstruc.2012.01.012.
NLG–. Dereli, Y. Erdogdu, M.T. Gulluoglu, E. TNLG¼rkkan, A. NLG–zmen, N. Sundaraganesan, "Vibrational spectral and quantum chemical investigations of tert-butyl-hydroquinone,.", Journal of Molecular Structure, Volume 1012, Number 1, Mar 2012, pp. 168-176. 2012/10.1016/j.molstruc.2012.01.003.
N. Sundaraganesan, G. Mariappan, S. Manoharan, "Molecular structure and vibrational spectroscopic studies of Chrysin using HF and Density Functional Theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 87, Number 1, Feb 2012, pp. 67-76. 2012/10.1016/j.saa.2011.11.011.
S. Kalaichelvan, N. Sundaraganesan, O. Dereli, U. Sayin, "Experimental, theoretical calculations of the vibrational spectra and conformational analysis of 2,4-di-tert-butylphenol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 85, Number 1, Jan 2012, pp. 198-209. 2012/10.1016/j.saa.2011.09.061.
M. Karabacak, Z. Cinar, M. Kurt, S. Sudha, N. Sundaraganesan, "FT-IR, FT-Raman, NMR and UVâ,“vis spectra, vibrational assignments and DFT calculations of 4-butyl benzoic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 85, Number 1, Jan 2012, pp. 179-189. 2012/10.1016/j.saa.2011.09.058.
M.K. Rofouei, E. Fereyduni, N. Sohrabi, M. Shamsipur, J. Attar, Gharamaleki, N. Sundaraganesan, "Synthesis, X-ray crystallography characterization, vibrational spectroscopic, molecular electrostatic potential maps, thermodynamic properties studies of N,Nâ,²-di(p-thiazole)formamidine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 1, Jan 2011, pp. 88-95. 2011/10.1016/j.saa.2010.08.077.
S. Sudha, N. Sundaraganesan, M. Kurt, M. Cinar, M. Karabacak , ", FT-IR and FT-Raman spectra, vibrational assignments, NBO analysis and DFT calculations of 2-amino-4-chlorobenzonitrile.", Journal of Molecular Structure, Volume 985, Number 2-3, Jan 2011, pp. 148-156. 2011/10.1016/j.molstruc.2010.10.035.
S. Sebastian, N. Sundaraganesan, B. Karthikeiyan, V. Srinivasan, "Quantum mechanical study of the structure and spectroscopic (FT-IR, FT-Raman, 13C, 1H and UV), first order hyperpolarizabilities, NBO and TD-DFT analysis of the 4-methyl-2-cyanobiphenyl.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 2, Feb 2011, pp. 590-600. 2011/10.1016/j.saa.2010.11.028.
S. Chandra, H. Saleem, S. Sebastian, N. Sundaraganesan, "The Spectroscopic (FTIR,FT-Raman),NCA, first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis of L-Cysteine by ab initio HF and Density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 5, May 2011, pp. 1515-1524. 2011/10.1016/j.saa.2011.01.043.
M.T. GNLG¼llNLG¼o"Ÿlu, Y. Erdogdu, J. Karpagam, N. Sundaraganesan, ...ž. Yurdakul , "DFT, FT-Raman, FT-IR and FT-NMR studies of 4-phenylimidazole,.", Journal of Molecular Structure, Volume 990, Number 1-3, Mar 2011, pp. 14-20. 2011/10.1016/j.molstruc.2011.01.001.
N. Subramanian, N. Sundaraganesan, S. Sudha, V. Aroulmoji, G.D. Sockalingam, M. Bergamin, "Experimental and theoretical investigation of the molecular and electronic structure of anticancer drug camptothecin.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 3, Mar 2011, pp. 1058-1067. 2011/10.1016/j.saa.2010.12.049.
NLG–. Dereli, S. Sudha, N. Sundaraganesan, "Molecular structure and vibrational spectra of 4-phenylsemicarbazide by density functional method.", Journal of Molecular Structure, Volume 994, Number 1-3, May 2011, pp. 379-386. 2011/10.1016/j.molstruc.2011.03.054.
P. Chinna Babu, N. Sundaraganesan, NLG–. Dereli, E. TNLG¼rkkan , "FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra and molecular geometry of butylated hydroxytoluene,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 79, Number 3, Aug 2011, pp. 562-569. 2011/10.1016/j.saa.2011.03.034.
M. Kurt, S. Okur, S. Demic, J. Karpagam and N. Sundaraganesan, "Synthesis and Raman spectroscopic investigation of a new self-assembly monolayer material 4-[N-phenyl-N-(3-methylphenyl)-amino]-benzoic acid for organic light-emitting devices,.", Journal Of Raman Spectroscopy, Volume 42, Number 8, Feb 2011, pp. 1682-1689. 2011/10.1002/jrs.2910.
M. Kurt, P. Chinna Babu, N. Sundaraganesan, M. Cinar, M.Karabacak , "Molecular structure, vibrational, UV and NBO analysis of 4-chloro-7-nitrobenzofurazan by DFT calculations,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 79, Number 5, Sep 2011, pp. 1162-1170. 2011/10.1016/j.saa.2011.04.037.
S.Chandra, H.Saleem, S.Sebastian, N. Sundaraganesan, "The Spectroscopic (FT-IR,FT-Raman), NCA, first order hyperpolarizability, NBO analysis, HOMO,LUMO analysis of L-Cysteine by ab initio HF and Density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 5, May 2011, pp. 1515-1524. 2011/.
Usha Rani, Halil Oturak, S.Sudha, "Molecular Sturcture, harmonic and anharmonic frequency calculations of 2,4-dichloropyrimidine by HF and density methods.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 5, May 2011, pp. 1467-1475. 2011/10.1016/j.saa.2011.01.028.
P.M.Anbarasan, M.K.Subramanian, S.Manimegalai, K.Suguna, V.Ilangovan, N. Sundaraganesan, "4-cholorotoluene:spectral studies and quantum chemical calculations.", Journal of Chemical and Pharmaceutical Research, Volume 3, Number 1, Jan 2011, pp. 123-136. 2011.
A.R.Krishnan, H.Saleem, S.Subashchandrabose, N. Sundaraganesan, S.Sebastian, "Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV and NBO analysis of 2-chlorobenzonitrile by density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 2, Feb 2011, pp. 582-589. 2011/10.1016/j.saa.2010.11.027.
M.Ramalingam, V.Sethuraman, N. Sundaraganesan, "Molecular structure, vibrational spectroscopic, first order hyperpolarizability and HOMO-LUMO studies of 7-amino-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 2, Feb 2011, pp. 660-669. 2011/10.1016/j.saa.2010.11.044.
S.P. Vijaya Chamundeeswari, E. James Jebaseelan Samuel, N. Sundaraganesan, "Quantum mechanical and spectroscopic (FT-IR, FT-Raman, 13C, 1H and UV) investigations of antiepileptic drug Ethosuximide.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 78, Number 2, Feb 2011, pp. 660-669. 2011/10.1016/j.saa.2010.11.044.
S. Sudha, M. Karabacak, M. Kurt, M. Cinar, N. Sundaraganesan, "Molecular structure, vibrational spectroscopic, first-order hyperpolarizability and HOMO, LUMO studies of 2-aminobenzimidazole,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 84, Number 1, Dec 2011, pp. 184-195. 2011/10.1016/j.saa.2011.09.028.
N. Subramanian, N. Sundaraganesan, NLG–. Dereli, E. TNLG¼rkkan, "FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra and molecular conformational analysis of 2,5-di-tert-butyl-hydroquinone.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 83, Number 1, Dec 2011, pp. 165-174. 2011/10.1016/j.saa.2011.08.010.
E. Fereyduni, E. Vessally, E. Yaaghubi, N. Sundaraganesan, "One-pot synthesis, FT-IR, NMR and density functional method (B3LYP) studies on 2-(cyclohexylamino)-2-oxo-1-(pyridin-2-yl)ethyl benzoate,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 81, Number 1, Oct 2011, pp. 64-71. 2011/10.1016/j.saa.2011.05.045.
J. Swaminathan, M. Ramalingam, V. Sethuraman, N. Sundaraganesan, S. Sebastian, M. Kurt, "FT-IR, FT-Raman, ab initio and DFT structural and vibrational frequency analysis of 6-aminopenicillanic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 75, Number 1, Jan 2010, pp. 183-190. 2010/10.1016/j.saa.2009.10.010.
S. Sebastian, N. Sundaraganesan, "The spectroscopic (FT-IR, FT-IR gas phase, FT-Raman and UV) and NBO analysis of 4-Hydroxypiperidine by density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 75, Number 3, Mar 2010, pp. 941-952. 2010/10.1016/j.saa.2009.11.030.
A. Usha Rani, N. Sundaraganesan, M. Kurt, M. Cinar, M. Karabacak , "FT-IR, FT-Raman, NMR spectra and DFT calculations on 4-chloro-N-methylaniline.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 75, Number 5, May 2010, pp. 1523-1529. 2010/0.1016/j.saa.2010.02.010.
M. Tahir GNLG¼llNLG¼oglu, Mustafa NLG–zduran, Mustafa Kurt, S. Kalaichelvan, N. Sundaraganesan, "Molecular structure and vibrational spectra of 2- and 5-methylbenzimidazole molecules by density functional theory.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 76, Number 2, Jul 2010, pp. 107-114. 2010/10.1016/j.saa.2010.02.032.
.K. Rofouei, N. Sohrabi, M. Shamsipur, E. Fereyduni, S. Ayyappan, N. Sundaraganesan , "X-ray crystallography characterization, vibrational spectroscopy, NMR spectra and quantum chemical DFT/HF study of N,Nâ,²-di(2-methoxyphenyl)formamidine .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 76, Number 2, Jul 2010, pp. 182-190. 2010/10.1016/j.saa.2010.03.009.
N. Subramanian, N. Sundaraganesan, J. Jayabharathi , "Molecular structure, spectroscopic (FT-IR, FT-Raman, NMR, UV) studies and first-order molecular hyperpolarizabilities of 1,2-bis(3-methoxy-4-hydroxybenzylidene)hydrazine by density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 76, Number 2, Jul 2010, pp. 259-269. 2010/10.1016/j.saa.2010.03.033.
S. Ayyappan, N. Sundaraganesan, V. Aroulmoji, E. Murano, S. Sebastian , ", Molecular structure, vibrational spectra and DFT molecular orbital calculations (TD-DFT and NMR) of the antiproliferative drug Methotrexate.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 77, Number 1, Sep 2010, pp. 264-275. 2010/10.1016/j.saa.2010.05.021.
E. Kavitha, N. Sundaraganesan, S. Sebastian, M. Kurt , "Molecular structure, anharmonic vibrational frequencies and NBO analysis of naphthalene acetic acid by density functional theory calculations.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 77, Number 3, Oct 2010, pp. 612-619. 2010/10.1016/j.saa.2010.06.034.
E. Kavitha, N. Sundaraganesan, S. Sebastian, M. Kurt , "Molecular structure, anharmonic vibrational frequencies and NBO analysis of naphthalene acetic acid by density functional theory calculations,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 77, Number 3, Oct 2010, pp. 612-619. 2010/10.1016/j.saa.2010.06.034.
C. Meganathan, S. Sebastian, M. Kurt, Keun Woo Lee and N. Sundaraganesan,, "Molecular structure, spectroscopic (FTIR, FTIR gas phase, FT-Raman) first-order hyperpolarizability and HOMOâ,“LUMO analysis of 4-methoxy-2-methyl benzoic acid.", Journal Of Raman Spectroscopy, Volume 41, Number 10, Jan 2010, pp. 1369-1378. 2010/https://doi.org/10.1002/jrs.2562.
. Ayyappan, N. Sundaraganesan, M. Kurt, T. R. Sertbakan and M. NLG–zduran, "Molecular structure, vibrational spectroscopic studies and NBO analysis of the 3,5-dichlorophenylboronic acid molecule by the density functional method.", Journal Of Raman Spectroscopy, Volume 41, Number 10, Jan 2010, pp. 1379-1387. 2010/10.1002/jrs.2576.
S. Subashchandrabose, Akhil R. Krishnan, H. Saleem, R. Parameswari, N. Sundaraganesan, V. Thanikachalam, G. Manikandan, "Vibrational spectroscopic study and NBO analysis on bis(4-amino-5-mercapto-1,2,4-triazol-3-yl) methane using DFT method,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 77, Number 4, Nov 2010, pp. 877-884. 2010/10.1016/j.saa.2010.08.023.
J.Karpagam, N. Sundaraganesan, S.Kalaichelvan, S.Sebastian, "Anharmonic vibrational analysis of 3,4-diaminopyridine and 3-aminopyridine by density functional theory calculations.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 76, Number 5, Sep 2010, pp. 502-512. 2010/10.1016/j.saa.2010.04.013.
J. Swaminathan, M. Ramalingam, N. Sundaraganesan , "Molecular structure and vibrational spectra of 3-amino-5-hydroxypyrazole by density functional method .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 71, Number 5, Jan 2009, pp. 1776-1782. 2009/10.1016/j.saa.2008.06.044.
N. Sundaraganesan, J. Karpagam, S. Sebastian, J.P. Cornard , "The spectroscopic (FTIR, FT-IR gas phase and FT-Raman), first order hyperpolarizabilities, NMR analysis of 2,4-dichloroaniline by ab initio HF and density functional methods.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 73, Number 1, Jul 2009, pp. 11-19. 2009/10.1016/j.saa.2009.01.007.
J. Swaminathan, M. Ramalingam, V. Sethuraman, N. Sundaraganesan, S. Sebastian , "Vibrational spectroscopic studies and DFT calculations of 4-aminoantipyrine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 73, Number 4, Aug 2009, pp. 593-600. 2009/10.1016/j.saa.2009.03.009.
N. Sundaraganesan, G. Elango, C. Meganathan, B. Karthikeyan & M. Kurt, "Molecular structure, vibrational spectra and HOMO, LUMO analysis of 4-piperidone by density functional theory and ab initio Hartreeâ,“Fock calculations.", Journal: Molecular Simulation, Volume 35, Number 9, Jun 2009, pp. 705-713. 2009/10.1080/08927020902873992.
S. Chandra, H. Saleem, N. Sundaraganesan, S. Sebastian,, "Experimental and theoretical vibrational spectroscopic and HOMO, LUMO studies of 1,3-dimethylbarbituric acid,.", IndianJournal of Chemistry, Volume 48A, Number 1, Sep 2009, pp. 1219-1227. 2009/ .
S. Sebastian, N. Sundaraganesan, S. Manoharan , "Molecular structure, spectroscopic studies and first-order molecular hyperpolarizabilities of ferulic acid by density functional study.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 74, Number 2, Oct 2009, pp. 312-323. 2009/ 10.1016/j.saa.2009.06.011.
S. Chandra, H. Saleem, N. Sundaraganesan, S. Sebastian, "The spectroscopic FT-IR gas phase, FT-IR, FT-Raman, polarizabilities analysis of Naphthoic acid by density functional methods.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 74, Number 3, Oct 2009, pp. 704-713. 2009/10.1016/j.saa.2009.07.025.
. Sundaraganesan, E. Kavitha, S. Sebastian, J.P. Cornard, M. Martel, "Experimental FTIR, FT-IR (gas phase), FT-Raman and NMR spectra, hyperpolarizability studies and DFT calculations of 3,5-dimethylpyrazole.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 74, Number 3, Oct 2009, pp. 788-791. 2009/10.1016/j.saa.2009.08.019.
S.A.Siddiqui, A.Dwivedi, P.K.Singh, T.Hasan, S.Jain, N. Sundaraganesan, H.Saleem, N.Misra, "Vibrational dynamics and potential energy distribution of two well-known neurotransmitter receptors: Tyramine and dopamine hydrochloride.", Journal of Theoretical and Computational Chemistry, Volume 8, Number 3, 2009, pp. 433-450. 2009/1142/S0219633609004861.
J. Karpagam, N. Sundaraganesan, S. Sebastian, S. Manoharan and M. Kurt, "Molecular structure, vibrational spectroscopic, first-order hyperpolarizability and HOMO, LUMO studies of 3-hydroxy-2-naphthoic acid hydrazide.", Journal Of Raman Spectroscopy, Volume 41, Number 1, Sep 2009, pp. 53-62. 2009/10.1002/jrs.2408.
N. Sundaraganesan, B. Anand, C. Meganathan, B. Dominic Joshua, H. Saleem , "Vibrational spectra and assignments of 3-aminobenzyl alcohol by ab initio Hartreeâ,“Fock and density functional method.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 69, Number 1, Jan 2008, pp. 198-204. 2008/ 10.1016/j.saa.2007.03.031.
N. Sundaraganesan, H. Umamaheswari, B. Dominic Joshua, C. Meganathan, M. Ramalingam , "Molecular structure and vibrational spectra of indole and 5-aminoindole by density functional theory and ab initio Hartreeâ,“Fock calculations.", Journal of Molecular Structure: THEOCHEM, Volume 850, Number 1-3, Feb 2008, pp. 84-93. 2008 /10.1016/j.theochem.2007.10.031.
N. Sundaraganesan, B. Anand, C. Meganathan, B. Dominic Joshua , "FT-IR, FT-Raman spectra and ab initio HF, DFT vibrational analysis of p-chlorobenzoic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 69, Number 3, Mar 2008, pp. 871-879. 2008/ 10.1016/j.saa.2007.05.051.
M.K. Subramanian, P.M. Anbarasan, V. Ilangovan & N. Sundaraganesan, "FT-IR, FT-Raman spectra and DFT vibrational analysis of 2-aminobiphenyl.", Journal Molecular Simulation, Volume 34, Number 3, May 2008, pp. 277-287. 2008/10.1080/08927020701829856.
N. Sundaraganesan, H. Umamaheswari, C. Meganathan & S. Sebastian, ", Molecular structure and vibrational spectra of 4-nitrobenzylchloride by ab initio Hartreeâ,“Fock and density functional methods.", , Journal: Molecular Simulation, Volume 34, Number 6, Aug 2008, pp. 619-630. 2008/10.1080/08927020802036013.
N. Sundaraganesan, M. Priya, C. Meganathan, B. Dominic Joshua, J.P. Cornard , ", FT-IR, FT-Raman spectra and quantum chemical calculations of 3,4-dimethoxyaniline.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 70, Number 1, Jun 2008, pp. 50-59. 2008/10.1016/j.saa.2007.07.026.
N. Sundaraganesan, B. Dominic Joshua, C. Meganathan, R. Meenashi, J.P. Cornard , "Vibrational spectra and quantum chemical calculations of 3,4-diaminobenzoic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 70, Number 2, Jul 2008, pp. 376-383. 2008/10.1016/j.saa.2007.10.051.
N. Sundaraganesan, C. Meganathan, B. Karthikeyan, "FT-IR, FT-Raman spectra and quantum chemical calculations of some chloro substituted phenoxy acetic acids.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 70, Number 2, Jul 2008, pp. 430-438. 2008/10.1016/j.saa.2007.12.022.
P. Mani, H. Umamaheswari, B. Dominic Joshua, N. Sundaraganesan , "Molecular structure, vibrational spectra and NBO analysis of phenylisothiocyanate by density functional method.", Journal of Molecular Structure: THEOCHEM, Volume 863, Number 1-3, Aug 2008, pp. 44-49. 2008/10.1016/j.theochem.2008.05.013.
M. Ramalingam, N. Sundaraganesan, H. Saleem, J. Swaminathan , "Experimental (FTIR and FT-Raman) and ab initio and DFT study of vibrational frequencies of 5-amino-2-nitrobenzoic acid,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 71, Number 1, Nov 2008, pp. 23-30. 2008/ 10.1016/j.saa.2007.11.016.
N. Sundaraganesan, C. Meganathan, Mustafa Kurt , "Molecular structure and vibrational spectra of 2-amino-5-methyl pyridine and 2-amino-6-methyl pyridine by density functional methods.", Journal of Molecular Structure, Volume 891, Number 1-3, Nov 2008, pp. 284-291. 2008/10.1016/j.molstruc.2008.03.051.
N. Sundaraganesan, S. Kalaichelvan, C. Meganathan, B. Dominic Joshua, J. Cornard , "FT-IR, FT-Raman spectra and ab initio HF and DFT calculations of 4-N,Nâ,²-dimethylamino pyridine, .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 71, Number 3, Dec 2008, pp. 896-906. 2008/10.1016/j.saa.2008.02.016.
M. Ramalingam, M. Jaccob, J. Swaminathan, P. Venuvanalingam, "Harmonic analysis of vibrations of morpholine-4-ylmethylthiourea: A DFT, midinfrared and Raman spectral study.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 71, Number 3, Dec 2008, pp. 996-1002. 2008/10.1016/j.saa.2008.02.034.
N. Sundaraganesan, C. Meganathan, B. Dominic Joshua, P. Mani, A. Jayaprakash , "Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional method,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 71, Number 3, Dec 2008, pp. 1134-1139. 2008/10.1016/j.saa.2008.03.019.
N. Sundaraganesan, S. Ayyappan, H. Umamaheswari, B. Dominic Joshua, "FTIR, FT-Raman spectra and ab initio, DFT vibrational analysis of 2,4-dinitrophenylhydrazine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 66, Number Issue 1, Jan 2007, pp. 17-27. 2007/ 10.1016/j.saa.2006.02.015.
N. Sundaraganesan, B. Dominic Joshua, K. Settu , "Vibrational spectra and assignments of 5-amino-2-chlorobenzoic acid by ab initio Hartreeâ,“Fock and density functional methods .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 66, Number Issue 2, Feb 2007, pp. 381-388. 2007/ 10.1016/j.saa.2006.03.008.
N. Sundaraganesan, C. Meganathan, B. Anand, Christine Lapouge , ", FT-IR, FT-Raman spectra and ab initio DFT vibrational analysis of p-bromophenoxyacetic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 66, Number 3, Mar 2007, pp. 773-780. 2007/10.1016/j.saa.2006.04.025.
N. Sundaraganesan, S. Illakiamani, C. Meganathan, B. Dominic Joshua , "Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 3-aminobenzotrifluoride.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 67, Number 1, May 2007, pp. 214-224. 2007/10.1016/j.saa.2006.07.004.
N. Sundaraganesan, S. Ilakiamani, B. Dominic Joshua, "FT-Raman and FT-IR spectra, ab initio and density functional studies of 2-amino-4,5-difluorobenzoic acid.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 67, Number 2, Jun 2007, pp. 287-297. 2007/ 10.1016/j.saa.2006.07.016.
N. Sundaraganesan, B. Anand, B. Dominic Joshua, "Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 2-amino-5-methylphenol ,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 67, Number 2, Jun 2007, pp. 550-558. 2007/ 10.1016/j.saa.2006.08.014.
N. Sundaraganesan, S. Ilakiamani, P. Subramani, B. Dominic Joshua , "Comparison of experimental and ab initio HF and DFT vibrational spectra of benzimidazole.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 67, Number 3-4, Jul 2007, pp. 628-635. 2007/10.1016/j.saa.2006.08.020.
N. Sundaraganesan, C. Meganathan, B. Anand, B. Dominic Joshua, Christine Lapouge , "Vibrational spectra and assignments of 2-amino-5-iodopyridine by ab initio Hartreeâ,“Fock and density functional methods,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 67, Number 3-4, Jul 2007, pp. 830-836. 2007/10.1016/j.saa.2006.08.040.
N. Sundaraganesan, B. Anand, C. Meganathan, B. Dominic Joshua , "FT-IR, FT-Raman spectra and ab initio HF, DFT vibrational analysis of 2,3-difluoro phenol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 68, Number 3, Nov 2007, pp. 561-566. 2007/10.1016/j.saa.2006.12.028.
N. Sundaraganesan, C. Meganathan, H. Saleem, B. Dominic Joshua , "Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 5-amino-o-cresol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 68, Number 3, Nov 2007, pp. 619-625. 2007/10.1016/j.saa.2006.12.036.
N. Sundaraganesan, S. Ilakiamani, B. Dominic Joshua, "Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 3,4-dimethylbenzaldehyde.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 68, Number 3, Nov 2007, pp. 680-687. 2007/10.1016/j.saa.2006.12.046.
N. Sundaraganesan, B. Dominic Joshua , "Vibrational spectra and fundamental structural assignments from HF and DFT calculations of methyl benzoate.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 68, Number 3, Nov 2007, pp. 771-777. 2007/ 10.1016/j.saa.2006.12.059.
Shamoon Ahmad Siddiqui, Apoorva Dwivedi, Neeraj Misra, N. Sundaraganesan, "Computational note on vibrational spectra of Tyramine hydrochloride: DFT study.", Journal of Molecular Structure: THEOCHEM, Volume 847, Number 1-3, Dec 2007, pp. 101-102. 2007/ 10.1016/j.theochem.2007.09.003.
N. Sundaraganesan, S. Ilakiamani, B. Anand, H. Saleem, B. Dominic Joshua, "FTIR, FT-Raman spectra and ab initio DFT vibrational analysis of 2-amino-5-chloropyridine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume 64, Number 3, Jun 2006, pp. 586-594. June 2006/10.1016/j.saa.2005.07.061.
R. Wysoki...„ski, D. Michalska, D.C. Bie...„ko, S. Ilakiamani, N. Sundaraganesan, K. Ramalingam, "Density functional study on the molecular structure, infrared and Raman spectra, and vibrational assignment for 4-thiocarbamoylpyridine,.", Journal of Molecular Structure, Volume Volume 791, Number Issues 1â,“3, Jun 2006, pp. 70-76. 19 June 2006/10.1016/j.molstruc.2005.12.044.
N. Sundaraganesan, K. Sathesh Kumar, C. Meganathan, B. Dominic Joshua, "Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 2-amino-4,6-dimethoxypyrimidine, .", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 65, Number Issue 5, Dec 2006, pp. 1186-1196. December 2006/10.1016/j.saa.2006.01.042.
N. Sundaraganesan, B. Anand, B. Dominic Joshua, " FTIR, FT-Raman spectra and ab initio DFT vibrational analysis of 2,4-dichloro-6-nitrophenol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 65, Number Issue 5, Dec 2006, pp. 1053-1062. 2006/10.1016/j.saa.2006.01.041.
N. Sundaraganesan, B. Anand, Fang-Fang Jian, Pusu Zhao, "FT-Raman and FT-IR spectra, ab initio and density functional studies of 3,4-dichlorobenzyl alcohol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 65,, Number Issues 3â,“4,, Nov 2006, pp. 826-832. 2006/10.1016/j.saa.2006.01.011.
N. Sundaraganesan, H. Saleem, S. Mohan, M. Ramalingam, "FT-Raman and FTIR spectra, assignments and ab initio calculations of 2-aminobenzyl alcohol,.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 61, , Number Issue 3, Jan 2005, pp. 377-385. 14 January 2005/10.1016/j.saa.2004.04.012.
N. Sundaraganesan, S. Ilakiamani, H. Saleem, Piotr. M. Wojciechowski, Danuta Michalska, "FT-Raman and FT-IR spectra, vibrational assignments and density functional studies of 5-bromo-2-nitropyridine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 61, , Number 13â,“14, Oct 2005, pp. 2995-3001. October 2005/ 10.1016/j.saa.2004.11.016.
N. Sundaraganesan, H. Saleem, S. Mohan, M. Ramalingam, V. Sethuraman, "FTIR, FT-Raman spectra and ab initio DFT vibrational analysis of 2-bromo-4-methyl-phenylamine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 62, , Number 1â,“3, Nov 2005, pp. 740-751. November 2005/10.1016/j.saa.2005.02.043.
N. Sundaraganesan, S. Ilakiamani, H. Saleem, Piotr. M. Wojciechowski, Danuta Michalska,Erratum, "FT-Raman and FT-IR spectra, vibrational assignments and density functional studies of 5-bromo-2-nitropyridine.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 61,, Number 13â,“14, Oct 2005, pp. 2995-3001. October 2005/10.1016/j.saa.2004.11.016.
N. Sundaraganesan, H. Saleem, S. Mohan, "Vibrational spectra, assignments and normal coordinate analysis of 2-amino-5-bromopyridine.", Spectrochimica Acta Part A, Volume Volume 59, Issue 5, Number Issue 5, Mar 2003, pp. 1113-1118. 2003/10.1016/S1386-1425(02)00285-8.
N Sundaraganesan, H Saleem, S Mohan, "Vibrational spectra, assignments and normal coordinate analysis of 3-aminobenzyl alcohol.", Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Volume Volume 59, , Number Issue 11, Sep 2003, pp. 2511-2517. September 2003/10.1016/s1386-1425(03)00037-4.
N Sundaraganesan, N Puviarasan, S Mohan, "Vibrational spectra, assignments and normal coordinate calculation of acrylamide.", Talanta, Volume Volume 54, Issue 2, Number , Issue 2, Apr 2001, pp. 233-241. 12 April 2001/10.1016/s0039-9140(00)00585-3.
S. Mohan, N. Sundaraganesan, J. Mink, "FTIR and Raman studies on benzimidazole.", Spectrochimica Acta Part A: Molecular Spectroscopy, Volume Volume 47, Number Issue 8, 1991, 1991, pp. 1111-1115. 1991/10.1016/0584-8539(91)80042-H.

List of Awards
Awarded with Senior Research Fellowship(SRF) - CSIR - 1992