146 related articles for article (PubMed ID: 22925983)
1. Synthesis, structural elucidation and spectroscopic analysis of 3a,8b-dihydroxy-4-oxo-1H,2H,3H,3aH,4H,8bH-indeno[1,2-d]imidazolidin-2-iminium chloride.
Uma Devi T; Priya S; Selvanayagam S; Ravikumar K; Anitha K
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():1063-71. PubMed ID: 22925983
[TBL] [Abstract][Full Text] [Related]
2. Crystal structure, spectroscopic characterization and density functional studies of (E)-1-((3-methoxyphenylimino)methyl)naphthalen-2-ol.
Alpaslan G; Macit M
Spectrochim Acta A Mol Biomol Spectrosc; 2014; 121():372-80. PubMed ID: 24280299
[TBL] [Abstract][Full Text] [Related]
3. Synthesis, X-ray structural, characterization, NBO and HOMO-LUMO analysis using DFT study of 4-methyl-N-(naphthalene-1-yl)benzene sulfonamide.
Sarojini K; Krishnan H; Kanakam CC; Muthu S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():657-67. PubMed ID: 22871549
[TBL] [Abstract][Full Text] [Related]
4. Molecular structure and vibrational bands and chemical shift assignments of 4-allyl-5-(2-hydroxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione by DFT and ab initio HF calculations.
Karakurt T; Dinçer M; Cetin A; Sekerci M
Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep; 77(1):189-98. PubMed ID: 20542728
[TBL] [Abstract][Full Text] [Related]
5. Synthesis, structural characterization and comparison of experimental and theoretical results by DFT level of molecular structure of 4-(4-methoxyphenethyl)-3,5-dimethyl-4H-1,2,4-triazole.
Düğdü E; Ünver Y; Ünlüer D; Tanak H; Sancak K; Köysal Y; Işık Ş
Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():329-37. PubMed ID: 23490260
[TBL] [Abstract][Full Text] [Related]
6. N-(4-nitrobenzoyl)-N'-(1,5-dimethyl-3-oxo-2-phenyl-1H-3(2H)-pyrazolyl)-thiourea hydrate: synthesis, spectroscopic characterization, X-ray structure and DFT studies.
Arslan NB; Kazak C; Aydın F
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Apr; 89():30-8. PubMed ID: 22240233
[TBL] [Abstract][Full Text] [Related]
7. Experimental and theoretical spectroscopic studies, HOMO-LUMO, NBO and NLMO analysis of 3,5-dibromo-2,6-dimethoxy pyridine.
Xavier RJ; Gobinath E
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():215-22. PubMed ID: 22765940
[TBL] [Abstract][Full Text] [Related]
8. The spectroscopic properties of anticancer drug Apigenin investigated by using DFT calculations, FT-IR, FT-Raman and NMR analysis.
Mariappan G; Sundaraganesan N; Manoharan S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Sep; 95():86-99. PubMed ID: 22617215
[TBL] [Abstract][Full Text] [Related]
9. N-cyclohexyl-2-[5-(4-pyridyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-ylsulfanyl]-acetamide dihydrate: synthesis, experimental, theoretical characterization and biological activities.
Orek C; Koparir P; Koparir M
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():923-34. PubMed ID: 22906969
[TBL] [Abstract][Full Text] [Related]
10. Structural study of 2-(1-oxo-1 H-inden-3-yl)-2H-indene-1,3-dione by DFT calculations, NMR and IR spectroscopy.
Riahi S; Ganjali MR; Moghaddam AB; Norouzi P; Hosseiny Davarani SS
Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jun; 70(1):94-8. PubMed ID: 17768082
[TBL] [Abstract][Full Text] [Related]
11. Crystal structure, spectroscopic investigations and density functional studies of 4-(4-methoxyphenethyl)-5-benzyl-2H-1,2,4-triazol-3(4H)-one monohydrate.
Köysal Y; Tanak H
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jul; 93():106-15. PubMed ID: 22465776
[TBL] [Abstract][Full Text] [Related]
12. Vibrational spectroscopic studies and DFT calculations of 4-bromo-o-xylene.
Arivazhagan M; Meenakshi R
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jun; 91():419-30. PubMed ID: 22430759
[TBL] [Abstract][Full Text] [Related]
13. Synthesis, X-ray crystallography characterization, vibrational spectroscopic, molecular electrostatic potential maps, thermodynamic properties studies of N,N'-di(p-thiazole)formamidine.
Rofouei MK; Fereyduni E; Sohrabi N; Shamsipur M; Attar Gharamaleki J; Sundaraganesan N
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Jan; 78(1):88-95. PubMed ID: 20943433
[TBL] [Abstract][Full Text] [Related]
14. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV-vis spectra, first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis, thermodynamic properties of benzophenone 2,4-dicarboxylic acid by ab initio HF and density functional method.
Chaitanya K
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 86():159-73. PubMed ID: 22137747
[TBL] [Abstract][Full Text] [Related]
15. 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]
16. Experimental and theoretical spectroscopic studies of anticancer drug rosmarinic acid using HF and density functional theory.
Mariappan G; Sundaraganesan N; Manoharan S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():340-51. PubMed ID: 22789527
[TBL] [Abstract][Full Text] [Related]
17. Experimental and theoretical investigation of the molecular and electronic structure of 3-ethoxy-4-isopropylaminocyclobut-3-ene-1,2-dione.
Süleymanoğlu N; Ustabaş R; Alpaslan YB; Eyduran F; İskeleli NO
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():35-41. PubMed ID: 22658995
[TBL] [Abstract][Full Text] [Related]
18. One-pot synthesis, FT-IR, NMR and density functional method (B3LYP) studies on 2-(cyclohexylamino)-2-oxo-1-(pyridin-2-yl)ethyl benzoate.
Fereyduni E; Vessally E; Yaaghubi E; Sundaraganesan N
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Oct; 81(1):64-71. PubMed ID: 21764364
[TBL] [Abstract][Full Text] [Related]
19. 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.
Sebastian S; Sundaraganesan N; Karthikeiyan B; Srinivasan V
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):590-600. PubMed ID: 21195659
[TBL] [Abstract][Full Text] [Related]
20. Crystal structure, DFT and HF calculations and radical scavenging activities of (E)-4,6-dibromo-3-methoxy-2-[(3-methoxyphenylimino)methyl]phenol.
Alaşalvar C; Soylu MS; Güder A; Albayrak Ç; Apaydın G; Dilek N
Spectrochim Acta A Mol Biomol Spectrosc; 2014 May; 125():319-27. PubMed ID: 24566110
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
