165 related articles for article (PubMed ID: 25315873)
1. Spectroscopic analysis of cinnamic acid using quantum chemical calculations.
Vinod KS; Periandy S; Govindarajan M
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():808-17. PubMed ID: 25315873
[TBL] [Abstract][Full Text] [Related]
2. 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]
3. Vibrational spectroscopic [FT-IR, FT-Raman] investigation on (2,4,5-Trichlorophenoxy) Acetic acid using computational [HF and DFT] analysis.
Karthikeyan N; Joseph Prince J; Ramalingam S; Periandy S
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 124():165-77. PubMed ID: 24486865
[TBL] [Abstract][Full Text] [Related]
4. Electronic [UV-Visible] and vibrational [FT-IR, FT-Raman] investigation and NMR-mass spectroscopic analysis of terephthalic acid using quantum Gaussian calculations.
Karthikeyan N; Prince JJ; Ramalingam S; Periandy S
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 139():229-42. PubMed ID: 25561302
[TBL] [Abstract][Full Text] [Related]
5. 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]
6. DFT calculations and experimental FT-IR, FT-Raman, NMR, UV-Vis spectral studies of 3-fluorophenylboronic acid.
Karabacak M; Kose E; Sas EB; Kurt M; Asiri AM; Atac A
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():306-20. PubMed ID: 25448934
[TBL] [Abstract][Full Text] [Related]
7. Spectroscopic (FT-IR, FT-Raman, UV and NMR) investigation and NLO, HOMO-LUMO, NBO analysis of organic 2,4,5-trichloroaniline.
Govindarajan M; Karabacak M; Periandy S; Tanuja D
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():231-45. PubMed ID: 22765942
[TBL] [Abstract][Full Text] [Related]
8. Molecular structure, vibrational analysis (FT-IR, FT-Raman), NMR, UV, NBO and HOMO-LUMO analysis of N,N-Diphenyl Formamide based on DFT calculations.
Mathammal R; Monisha NR; Yasaswini S; Krishnakumar V
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 139():521-32. PubMed ID: 25579654
[TBL] [Abstract][Full Text] [Related]
9. Molecular vibrational investigation [FT-IR, FT-Raman, UV-Visible and NMR] on Bis(thiourea) Nickel chloride using HF and DFT calculations.
Anand S; Sundararajan RS; Ramachandraraja C; Ramalingam S; Durga R
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Mar; 138():203-15. PubMed ID: 25498815
[TBL] [Abstract][Full Text] [Related]
10. FTIR, FT-RAMAN, NMR, spectra, normal co-ordinate analysis, NBO, NLO and DFT calculation of N,N-diethyl-4-methylpiperazine-1-carboxamide molecule.
Muthu S; Elamurugu Porchelvi E
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():275-86. PubMed ID: 23845985
[TBL] [Abstract][Full Text] [Related]
11. The spectroscopic (FT-IR, FT-Raman, dispersive Raman and NMR) study of ethyl-6-chloronicotinate molecule by combined density functional theory.
Karabacak M; Calisir Z; Kurt M; Kose E; Atac A
Spectrochim Acta A Mol Biomol Spectrosc; 2016 Jan; 153():754-70. PubMed ID: 26483317
[TBL] [Abstract][Full Text] [Related]
12. Conformational analysis, spectroscopic study (FT-IR, FT-Raman, UV, 1H and 13C NMR), molecular orbital energy and NLO properties of 5-iodosalicylic acid.
Karaca C; Atac A; Karabacak M
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():295-305. PubMed ID: 25448933
[TBL] [Abstract][Full Text] [Related]
13. Spectroscopic [FT-IR and FT-Raman] and theoretical [UV-Visible and NMR] analysis on α-Methylstyrene by DFT calculations.
Karthikeyan N; Joseph Prince J; Ramalingam S; Periandy S
Spectrochim Acta A Mol Biomol Spectrosc; 2015 May; 143():107-19. PubMed ID: 25721781
[TBL] [Abstract][Full Text] [Related]
14. Spectroscopic (FT-IR/FT-Raman) and computational (HF/DFT) investigation and HOMO/LUMO/MEP analysis on 1,1-difluoro-2-vinyl-cyclopropane.
Senthil Raj P; Shoba D; Ramalingam S; Periandy S
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Aug; 147():293-302. PubMed ID: 25854609
[TBL] [Abstract][Full Text] [Related]
15. Molecular structure investigation and spectroscopic studies on 2,3-difluorophenylboronic acid: a combined experimental and theoretical analysis.
Karabacak M; Kose E; Atac A; Ali Cipiloglu M; Kurt M
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():892-908. PubMed ID: 22902933
[TBL] [Abstract][Full Text] [Related]
16. Vibrational spectroscopic studies, NLO, HOMO-LUMO and electronic structure calculations of α,α,α-trichlorotoluene using HF and DFT.
Govindarajan M; Karabacak M; Periandy S; Xavier S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Aug; 94():53-64. PubMed ID: 22516115
[TBL] [Abstract][Full Text] [Related]
17. 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]
18. Insilico molecular modeling, docking and spectroscopic [FT-IR/FT-Raman/UV/NMR] analysis of Chlorfenson using computational calculations.
Ramalingam S; Periandy S; Sugunakala S; Prabhu T; Bououdina M
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Nov; 115():118-35. PubMed ID: 23832220
[TBL] [Abstract][Full Text] [Related]
19. Spectroscopic analysis (FT-IR/FT-Raman) and molecular structure investigation on m-fluoronitrobenzene using hybrid computational calculations.
Ramalingam S; Karabacak M; Periandy S; Puviarasan N
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Aug; 94():318-30. PubMed ID: 22534557
[TBL] [Abstract][Full Text] [Related]
20. Spectroscopic and quantum chemical analysis of Isonicotinic acid methyl ester.
Shoba D; Periandy S; Govindarajan M; Gayathri P
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():852-63. PubMed ID: 25459608
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
