209 related articles for article (PubMed ID: 23563635)
1. Structural conformations and density functional study on the intramolecular charge transfer based on vibrational spectra of 2,4-dihydroxy-N'-(4-methoxybenzylidene)benzohydrazide.
Suresh DM; Sajan D; Diao YP; Němec I; Hubert Joe I; Bena Jothy V
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Jun; 110():157-68. PubMed ID: 23563635
[TBL] [Abstract][Full Text] [Related]
2. Vibrational spectra, structural conformations, scaled quantum chemical calculations and NBO analysis of 3-acetyl-7-methoxycoumarin.
Joseph L; Sajan D; Reshmy R; Arun Sasi BS; Erdogdu Y; Thomas KK
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Dec; 99():234-47. PubMed ID: 23078790
[TBL] [Abstract][Full Text] [Related]
3. Vibrational spectroscopy investigation and density functional theory calculations on (E)-N'-(4-methoxybenzylidene) benzohydrazide.
Saleem H; Subashchandrabose S; Ramesh Babu N; Syed Ali Padusha M
Spectrochim Acta A Mol Biomol Spectrosc; 2015 May; 143():230-41. PubMed ID: 25733250
[TBL] [Abstract][Full Text] [Related]
4. Molecular conformational analysis, vibrational spectra and normal coordinate analysis of trans-1,2-bis(3,5-dimethoxy phenyl)-ethene based on density functional theory calculations.
Joseph L; Sajan D; Chaitanya K; Isac J
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Mar; 122():375-86. PubMed ID: 24317264
[TBL] [Abstract][Full Text] [Related]
5. Conformational stability, vibrational spectra, HOMO-LUMO and NBO analysis of 1,3,4-thiadiazolidine-2,5-dithione with experimental (FT-IR and FT-Raman) techniques and scaled quantum mechanical calculations.
Xavier RJ; Dinesh P
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Sep; 113():171-81. PubMed ID: 23727670
[TBL] [Abstract][Full Text] [Related]
6. FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra and molecular geometry of butylated hydroxy toluene.
Babu PC; Sundaraganesan N; Dereli Ö; Türkkan E
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Aug; 79(3):562-9. PubMed ID: 21501967
[TBL] [Abstract][Full Text] [Related]
7. Synthesis, structural and spectral analysis of (E)-N'-(4-Methoxybenzylidene)pyridine-3-carbohydrazide dihydrate by density functional theory.
Govindarasu K; Kavitha E; Sundaraganesan N; Suresh M; Syed Ali Padusha M
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():1123-36. PubMed ID: 25189524
[TBL] [Abstract][Full Text] [Related]
8. Quantum mechanical study of the structure and vibrational spectroscopic (FT-IR and FT-Raman), first-order hyperpolarizability, NBO and HOMO-LUMO studies of 4-bromo-3-nitroanisole.
Balachandran V; Karunakaran V
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Apr; 106():284-98. PubMed ID: 23416886
[TBL] [Abstract][Full Text] [Related]
9. 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]
10. Synthesis, FTIR, FT-Raman, UV-visible, ab initio and DFT studies on benzohydrazide.
Arjunan V; Rani T; Mythili CV; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Aug; 79(3):486-96. PubMed ID: 21531171
[TBL] [Abstract][Full Text] [Related]
11. 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.
Meganathan C; Sebastian S; Sivanesan I; Lee KW; Jeong BR; Oturak H; Sudha S; Sundaraganesan N
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Sep; 95():331-40. PubMed ID: 22561753
[TBL] [Abstract][Full Text] [Related]
12. DFT, FT-Raman, FT-IR, HOMO-LUMO and NBO studies of 4-Methylmorpholine.
Balachandran V; Mahalakshmi G; Lakshmi A; Janaki A
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Nov; 97():1101-10. PubMed ID: 22929905
[TBL] [Abstract][Full Text] [Related]
13. FT-IR, FT-Raman and computational study of (E)-N-carbamimidoyl-4-((4-methoxybenzylidene)amino)benzenesulfonamide.
Chandran A; Varghese HT; Mary YS; Panicker CY; Manojkumar TK; Van Alsenoy C; Rajendran G
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jun; 92():84-90. PubMed ID: 22446754
[TBL] [Abstract][Full Text] [Related]
14. Quantum chemical characterization of N-(2-hydroxybenzylidene)acetohydrazide (HBAH): a detailed vibrational and NLO analysis.
Tamer Ö; Avcı D; Atalay Y
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 117():78-86. PubMed ID: 23981418
[TBL] [Abstract][Full Text] [Related]
15. Molecular structure, vibrational spectroscopic (FT-IR, FT-Raman), UV and NBO analysis of 2-chlorobenzonitrile by density functional method.
Krishnan AR; Saleem H; Subashchandrabose S; Sundaraganesan N; Sebastain S
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Feb; 78(2):582-9. PubMed ID: 21190895
[TBL] [Abstract][Full Text] [Related]
16. Study on the structure and vibrational spectra of efavirenz conformers using DFT: comparison to experimental data.
Mishra S; Tandon P; Ayala AP
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Mar; 88():116-23. PubMed ID: 22206896
[TBL] [Abstract][Full Text] [Related]
17. FT-IR, FT-Raman, NMR studies and ab initio-HF, DFT-B3LYP vibrational analysis of 4-chloro-2-fluoroaniline.
Arivazhagan M; Anitha Rexalin D
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():668-76. PubMed ID: 22885079
[TBL] [Abstract][Full Text] [Related]
18. 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]
19. 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]
20. Vibrational spectroscopic, electronic and quantum chemical investigations on 2,3-hexadiene.
Jayaprakash A; Arjunan V; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Oct; 81(1):620-30. PubMed ID: 21763179
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
