These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
410 related articles for article (PubMed ID: 23123238)
1. FT-IR, FT-Raman and UV spectral investigation: computed frequency estimation analysis and electronic structure calculations on 1-bromo-2-methylnaphthalene. Govindarajan M; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2013 Jan; 101():314-24. PubMed ID: 23123238 [TBL] [Abstract][Full Text] [Related]
2. FT-IR, FT-Raman and UV spectral investigation; computed frequency estimation analysis and electronic structure calculations on 1-nitronaphthalene. Govindarajan M; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jan; 85(1):251-60. PubMed ID: 22024459 [TBL] [Abstract][Full Text] [Related]
3. FT-IR, FT-Raman and UV spectral investigation: computed frequency estimation analysis and electronic structure calculations on chlorobenzene using HF and DFT. Govindarajan M; Karabacak M; Udayakumar V; Periandy S Spectrochim Acta A Mol Biomol Spectrosc; 2012 Mar; 88():37-48. PubMed ID: 22197345 [TBL] [Abstract][Full Text] [Related]
4. FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on 4-chloro-3-nitrotoluene. Govindarajan M; Karabacak M; Suvitha A; Periandy S Spectrochim Acta A Mol Biomol Spectrosc; 2012 Apr; 89():137-48. PubMed ID: 22261102 [TBL] [Abstract][Full Text] [Related]
5. FT-IR and FT-Raman spectra, thermo dynamical behavior, HOMO and LUMO, UV, NLO properties, computed frequency estimation analysis and electronic structure calculations on α-bromotoluene. Govindarajan M; Periandy S; Carthigayen K Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():411-22. PubMed ID: 22820044 [TBL] [Abstract][Full Text] [Related]
6. Experimental (FT-IR and FT-Raman), electronic structure and DFT studies on 1-methoxynaphthalene. Govindarajan M; Ganasan K; Periandy S; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2011 Aug; 79(3):646-53. PubMed ID: 21530378 [TBL] [Abstract][Full Text] [Related]
7. Electronic absorption, vibrational spectra, nonlinear optical properties, NBO analysis and thermodynamic properties of N-(4-nitro-2-phenoxyphenyl) methanesulfonamide molecule by ab initio HF and density functional methods. Rajamani T; Muthu S; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():186-96. PubMed ID: 23474478 [TBL] [Abstract][Full Text] [Related]
8. Structural study, NCA, FT-IR, FT-Raman spectral investigations, NBO analysis and thermodynamic properties of 2',4'-difluoroacetophenone by HF and DFT calculations. Parimala K; Balachandran V Spectrochim Acta A Mol Biomol Spectrosc; 2013 Jun; 110():269-84. PubMed ID: 23578535 [TBL] [Abstract][Full Text] [Related]
9. FTIR and FT Raman, molecular geometry, vibrational assignments, ab initio and density functional theory calculations for 1,5-methylnaphthalene. Nagabalasubramanian PB; Periandy S Spectrochim Acta A Mol Biomol Spectrosc; 2010 Dec; 77(5):1099-107. PubMed ID: 20933463 [TBL] [Abstract][Full Text] [Related]
10. Vibrational frequency analysis, FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on pycolinaldehyde oxime. Suvitha A; Periandy S; Boomadevi S; Govindarajan M Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 117():216-24. PubMed ID: 23994677 [TBL] [Abstract][Full Text] [Related]
11. Spectroscopic properties, NLO, HOMO-LUMO and NBO analysis of 2,5-Lutidine. Govindarajan M; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():421-35. PubMed ID: 22722076 [TBL] [Abstract][Full Text] [Related]
12. Spectroscopic (infrared, Raman, UV and NMR) analysis, Gaussian hybrid computational investigation (MEP maps/HOMO and LUMO) on cyclohexanone oxime. Ramalingam S; Karabacak M; Periandy S; Puviarasan N; Tanuja D Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():207-20. PubMed ID: 22683556 [TBL] [Abstract][Full Text] [Related]
13. Spectroscopic (FT-IR/FT-Raman) and computational (HF/DFT) investigation and HOMO/LUMO/MEP analysis on 2-amino-4-chlorophenol. Ramalingam S; Periandy S; Karabacak M; Karthikeyan N Spectrochim Acta A Mol Biomol Spectrosc; 2013 Mar; 104():337-51. PubMed ID: 23274261 [TBL] [Abstract][Full Text] [Related]
14. Vibrational spectra and normal coordinate analysis of 2-hydroxy-3-(2-methoxyphenoxy) propyl carbamate. Muthu S; Renuga S Spectrochim Acta A Mol Biomol Spectrosc; 2014 Nov; 132():313-25. PubMed ID: 24878438 [TBL] [Abstract][Full Text] [Related]
15. Analysis of vibrational spectra (FT-IR and FT-Raman) and nonlinear optical properties of organic 2-chloro-p-xylene. Govindarajan M; Karabacak M Spectrochim Acta A Mol Biomol Spectrosc; 2012 Aug; 94():36-47. PubMed ID: 22510490 [TBL] [Abstract][Full Text] [Related]
16. Vibrational analysis using FT-IR, FT-Raman spectra and HF-DFT methods and NBO, NLO, NMR, HOMO-LUMO, UV and electronic transitions studies on 2,2,4-trimethyl pentane. Suvitha A; Periandy S; Govindarajan M; Gayathri P Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 138():900-12. PubMed ID: 25459692 [TBL] [Abstract][Full Text] [Related]
17. Spectroscopic studies (FTIR, FT-Raman and UV), potential energy surface scan, normal coordinate analysis and NBO analysis of (2R,3R,4R,5S)-1-(2-hydroxyethyl)-2-(hydroxymethyl) piperidine-3,4,5-triol by DFT methods. Isac Paulraj E; Muthu S Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():38-49. PubMed ID: 23454843 [TBL] [Abstract][Full Text] [Related]
18. Ab initio HF and DFT simulations, FT-IR and FT-Raman vibrational analysis of alpha-chlorotoluene. Nagabalasubramanian PB; Periandy S; Mohan S Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep; 77(1):150-9. PubMed ID: 20537941 [TBL] [Abstract][Full Text] [Related]
19. Spectroscopic (FT-IR, FT-Raman, NMR and UV-Visible) and quantum chemical studies of molecular geometry, Frontier molecular orbital, NLO, NBO and thermodynamic properties of salicylic acid. Suresh S; Gunasekaran S; Srinivasan S Spectrochim Acta A Mol Biomol Spectrosc; 2014 Nov; 132():130-41. PubMed ID: 24858354 [TBL] [Abstract][Full Text] [Related]
20. DFT (LSDA, B3LYP and B3PW91) comparative vibrational spectroscopic analysis of alpha-acetonaphthone. Govindarajan M; Ganasan K; Periandy S; Mohan S Spectrochim Acta A Mol Biomol Spectrosc; 2010 Jun; 76(1):12-21. PubMed ID: 20308014 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]