194 related articles for article (PubMed ID: 23000928)
1. Quantum chemical studies and vibrational analysis of 4-acetyl benzonitrile, 4-formyl benzonitrile and 4-hydroxy benzonitrile--a comparative study.
Arjunan V; Carthigayan K; Periandy S; Balamurugan K; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Dec; 98():156-69. PubMed ID: 23000928
[TBL] [Abstract][Full Text] [Related]
2. A comparative study on vibrational, conformational and electronic structure of α,α'-diol-o-xylene, α,α'-diol-m-xylene and α,α'-diol-p-xylene.
Arjunan V; Saravanan I; Mythili CV; Kalaivani M; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jun; 92():1-15. PubMed ID: 22402573
[TBL] [Abstract][Full Text] [Related]
3. Density functional theory studies on vibrational and electronic spectra of 2-chloro-6-methoxypyridine.
Arjunan V; Isaac AS; Rani T; Mythili CV; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2011 May; 78(5):1625-32. PubMed ID: 21382743
[TBL] [Abstract][Full Text] [Related]
4. DFT and ab initio quantum chemical studies on p-cyanobenzoic acid.
Arjunan V; Rani T; Varalakshmy L; Mohan S; Tedlamelekot F
Spectrochim Acta A Mol Biomol Spectrosc; 2011 May; 78(5):1449-54. PubMed ID: 21349760
[TBL] [Abstract][Full Text] [Related]
5. A scaled quantum mechanical approach of vibrational analysis of o-tolunitrile based on FTIR and FT Raman spectra, ab initio, Hartree Fock and DFT methods.
Nagabalasubramanian PB; Periandy S; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2009 Dec; 74(5):1280-7. PubMed ID: 19875327
[TBL] [Abstract][Full Text] [Related]
6. FTIR, FT-Raman, FT-NMR and quantum chemical investigations of 3-acetylcoumarin.
Arjunan V; Sakiladevi S; Marchewka MK; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 109():79-89. PubMed ID: 23501720
[TBL] [Abstract][Full Text] [Related]
7. Vibrational, conformational and electronic structure investigations of α,α'-dibromo-o-xylene, α,α'-dibromo-m-xylene and α,α'-dibromo-p-xylene.
Arjunan V; Saravanan I; Mythili CV; Balakrishnan K; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jun; 91():166-77. PubMed ID: 22381787
[TBL] [Abstract][Full Text] [Related]
8. Structural, vibrational and DFT studies on 2-chloro-1H-isoindole-1,3(2H)-dione and 2-methyl-1H-isoindole-1,3(2H)-dione.
Arjunan V; Saravanan I; Ravindran P; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2009 Oct; 74(3):642-9. PubMed ID: 19660980
[TBL] [Abstract][Full Text] [Related]
9. 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]
10. Quantum chemical and spectroscopic investigations of 5-aminoquinoline.
Arjunan V; Mohan S; Balamourougane PS; Ravindran P
Spectrochim Acta A Mol Biomol Spectrosc; 2009 Dec; 74(5):1215-23. PubMed ID: 19854675
[TBL] [Abstract][Full Text] [Related]
11. Investigation of the structural and harmonic vibrational properties of 2-nitro-, 4-nitro- and 5-nitro-m-xylene by ab initio and density functional theory.
Arjunan V; Balamourougane PS; Saravanan I; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2009 Oct; 74(3):798-807. PubMed ID: 19716338
[TBL] [Abstract][Full Text] [Related]
12. DFT simulations and vibrational analysis of FTIR and FT-Raman spectra of 2-amino-4-methyl benzonitrile.
Dheivamalar S; Silambarasan V
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():480-4. PubMed ID: 22728284
[TBL] [Abstract][Full Text] [Related]
13. Conformational, structural, vibrational and quantum chemical analysis on 4-aminobenzohydrazide and 4-hydroxybenzohydrazide--a comparative study.
Arjunan V; Jayaprakash A; Carthigayan K; Periandy S; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2013 May; 108():100-14. PubMed ID: 23466320
[TBL] [Abstract][Full Text] [Related]
14. Vibrational spectroscopic investigations, ab initio and DFT studies on 7-bromo-5-chloro-8-hydroxyquinoline.
Arjunan V; Mohan S; Ravindran P; Mythili CV
Spectrochim Acta A Mol Biomol Spectrosc; 2009 May; 72(4):783-8. PubMed ID: 19112045
[TBL] [Abstract][Full Text] [Related]
15. FT-IR, FT-Raman spectra and other molecular properties of 3,5-dichlorobenzonitrile: a DFT study.
Alcolea Palafox M; Bena Jothy V; Singhal S; Hubert Joe I; Kumar S; Rastogi VK
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Dec; 116():509-17. PubMed ID: 23978738
[TBL] [Abstract][Full Text] [Related]
16. FTIR and FT Raman spectra, vibrational assignments, ab initio, DFT and normal coordinate analysis of alpha,alpha dichlorotoluene.
Nagabalasubramanian PB; Periandy S; Mohan S; Govindarajan M
Spectrochim Acta A Mol Biomol Spectrosc; 2009 Jul; 73(2):277-80. PubMed ID: 19345137
[TBL] [Abstract][Full Text] [Related]
17. Vibrational spectroscopy (FT-IR and FT-Raman) investigation, and hybrid computational (HF and DFT) analysis on the structure of 2,3-naphthalenediol.
Shoba D; Periandy S; Karabacak M; Ramalingam S
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Dec; 83(1):540-52. PubMed ID: 21943712
[TBL] [Abstract][Full Text] [Related]
18. FTIR, FT-Raman, ab initio and density functional studies on 4-methyl-1,3-dioxolan-2-one and 4,5-dichloro-1,3-dioxolan-2-one.
Arjunan V; Saravanan I; Ravindran P; Mohan S
Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep; 77(1):28-35. PubMed ID: 20605517
[TBL] [Abstract][Full Text] [Related]
19. Determination of structural and vibrational spectroscopic properties of 2-, 3-, 4-nitrobenzenesulfonamide using FT-IR and FT-Raman experimental techniques and DFT quantum chemical calculations.
Karabacak M; Postalcilar E; Cinar M
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Jan; 85(1):261-70. PubMed ID: 22032973
[TBL] [Abstract][Full Text] [Related]
20. Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional method.
Sundaraganesan N; Meganathan C; Joshua BD; Mani P; Jayaprakash A
Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec; 71(3):1134-9. PubMed ID: 18448383
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]