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231 related items for PubMed ID: 16303626

  • 1. Structural and vibrational investigation of para-nitraminopyridine N-oxide. A combined experimental and theoretical studies.
    Oszust J, Baran J, Pietraszko A, Drozd M, Talik Z.
    Spectrochim Acta A Mol Biomol Spectrosc; 2005 Dec; 62(4-5):773-89. PubMed ID: 16303626
    [Abstract] [Full Text] [Related]

  • 2. The molecular structure and vibrational spectra of N-(2,2-diphenylacetyl)-N'-(naphthalen-1yl)-thiourea by Hartree-Fock and density functional methods.
    Arslan H, Mansuroglu DS, Vanderveer D, Binzet G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Apr; 72(3):561-71. PubMed ID: 19097820
    [Abstract] [Full Text] [Related]

  • 3. FT-IR and FT-Raman vibrational spectra and molecular structure investigation of nicotinamide: A combined experimental and theoretical study.
    Ramalingam S, Periandy S, Govindarajan M, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 May; 75(5):1552-8. PubMed ID: 20227335
    [Abstract] [Full Text] [Related]

  • 4. Vibrational spectra and fundamental structural assignments from HF and DFT calculations of methyl benzoate.
    Sundaraganesan N, Joshua BD.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Nov; 68(3):771-7. PubMed ID: 17433769
    [Abstract] [Full Text] [Related]

  • 5. Vibrational spectra and assignments of 2-amino-5-iodopyridine by ab initio Hartree-Fock and density functional methods.
    Sundaraganesan N, Meganathan C, Anand B, Joshua BD, Lapouge C.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jul; 67(3-4):830-6. PubMed ID: 17018261
    [Abstract] [Full Text] [Related]

  • 6. FT-Raman and FT-IR spectra, vibrational assignments and density functional studies of 5-bromo-2-nitropyridine.
    Sundaraganesan N, Ilakiamani S, Saleem H, Wojciechowski PM, Michalska D.
    Spectrochim Acta A Mol Biomol Spectrosc; 2005 Oct; 61(13-14):2995-3001. PubMed ID: 16165042
    [Abstract] [Full Text] [Related]

  • 7. FT-IR, FT-Raman vibrational spectra and molecular structure investigation of 2-chloro-4-methylaniline: a combined experimental and theoretical study.
    Karabacak M, Karagöz D, Kurt M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Jun; 72(5):1076-83. PubMed ID: 19213598
    [Abstract] [Full Text] [Related]

  • 8. FT-IR, FT-Raman spectra and ab initio DFT vibrational analysis of p-bromophenoxyacetic acid.
    Sundaraganesan N, Meganathan C, Anand B, Lapouge C.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Mar; 66(3):773-80. PubMed ID: 16870498
    [Abstract] [Full Text] [Related]

  • 9. 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 01; 71(3):1134-9. PubMed ID: 18448383
    [Abstract] [Full Text] [Related]

  • 10. Vibrational spectra and assignments of 3-aminobenzyl alcohol by ab initio Hartree-Fock and density functional method.
    Sundaraganesan N, Anand B, Meganathan C, Joshua BD, Saleem H.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jan 01; 69(1):198-204. PubMed ID: 17512242
    [Abstract] [Full Text] [Related]

  • 11. Vibrational spectrum and assignments of 2-(4-methoxyphenyl)-1H-benzo[d]imidazole by ab initio Hartree-Fock and density functional methods.
    Arslan H, Algül O.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jun 01; 70(1):109-16. PubMed ID: 17728175
    [Abstract] [Full Text] [Related]

  • 12. FT-IR, FT-Raman spectra and quantum chemical calculations of 3,4-dimethoxyaniline.
    Sundaraganesan N, Priya M, Meganathan C, Joshua BD, Cornard JP.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jun 01; 70(1):50-9. PubMed ID: 17765601
    [Abstract] [Full Text] [Related]

  • 13. Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 3-aminobenzotrifluoride.
    Sundaraganesan N, Illakiamani S, Meganathan C, Joshua BD.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 May 01; 67(1):214-24. PubMed ID: 16945578
    [Abstract] [Full Text] [Related]

  • 14. Comparison of experimental and ab initio HF and DFT vibrational spectra of benzimidazole.
    Sundaraganesan N, Ilakiamani S, Subramani P, Joshua BD.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jul 01; 67(3-4):628-35. PubMed ID: 16979935
    [Abstract] [Full Text] [Related]

  • 15. FT-IR, FT-Raman spectra and quantum chemical calculations of some chloro substituted phenoxy acetic acids.
    Sundaraganesan N, Meganathan C, Karthikeyan B.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jul 01; 70(2):430-8. PubMed ID: 18282793
    [Abstract] [Full Text] [Related]

  • 16. Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 2-amino-5-methylphenol.
    Sundaraganesan N, Anand B, Joshua BD.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jun 01; 67(2):550-8. PubMed ID: 16996297
    [Abstract] [Full Text] [Related]

  • 17. FT-Raman and FT-IR spectra, ab initio and density functional studies of 3,4-dichlorobenzyl alcohol.
    Sundaraganesan N, Anand B, Jian FF, Zhao P.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Nov 01; 65(3-4):826-32. PubMed ID: 16574470
    [Abstract] [Full Text] [Related]

  • 18. Anharmonic vibrational analysis of 3,4-diaminopyridine and 3-aminopyridine by density functional theory calculations.
    Karpagam J, Sundaraganesan N, Kalaichelvan S, Sebastian S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Sep 01; 76(5):502-12. PubMed ID: 20483656
    [Abstract] [Full Text] [Related]

  • 19. FT-IR, NIR-FT-Raman and gas phase infrared spectra of 3-aminoacetophenone by density functional theory and ab initio Hartree-Fock calculations.
    Subramanian MK, Anbarasan PM, Ilangovan V, Babu SM.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Nov 01; 71(1):59-67. PubMed ID: 18178129
    [Abstract] [Full Text] [Related]

  • 20. Molecular structure, spectroscopic studies and first-order molecular hyperpolarizabilities of ferulic acid by density functional study.
    Sebastian S, Sundaraganesan N, Manoharan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Oct 01; 74(2):312-23. PubMed ID: 19581124
    [Abstract] [Full Text] [Related]

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