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Journal Abstract Search

406 related items for PubMed ID: 16024279

  • 1. Vibrational assignment, structure and intramolecular hydrogen bond study of 3-amino-1-phenyl-2-buten-1-one.
    Raissi H, Yarali A, Farzad F, Nowroozi A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Mar 01; 63(3):729-39. PubMed ID: 16024279
    [Abstract] [Full Text] [Related]

  • 2. Vibrational assignment, structure and intramolecular hydrogen bond of 4-methylamino-3-penten-2-one.
    Raissi H, Moshfeghi E, Farzad F.
    Spectrochim Acta A Mol Biomol Spectrosc; 2005 Dec 01; 62(4-5):1004-15. PubMed ID: 15996514
    [Abstract] [Full Text] [Related]

  • 3. Intramolecular hydrogen bond, molecular structure and vibrational assignment of tetra-acetylethane. A density functional study.
    Raissi H, Nowroozi A, Mohammdi R, Hakimi M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Nov 01; 65(3-4):605-15. PubMed ID: 16529999
    [Abstract] [Full Text] [Related]

  • 4. 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]

  • 5. Density functional theory study of the Fourier transform infrared and Raman spectra of Cu(II) bis-acetylacetone.
    Raissi H, Nowroozi A, Farzad F, Bojd MS.
    Spectrochim Acta A Mol Biomol Spectrosc; 2005 Nov 01; 62(1-3):343-52. PubMed ID: 16257735
    [Abstract] [Full Text] [Related]

  • 6. Experimental (FTIR and FT-Raman) and ab initio and DFT study of vibrational frequencies of 5-amino-2-nitrobenzoic acid.
    Ramalingam M, Sundaraganesan N, Saleem H, Swaminathan J.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Nov 01; 71(1):23-30. PubMed ID: 18178128
    [Abstract] [Full Text] [Related]

  • 7. FTIR and FT Raman, molecular geometry, vibrational assignments, ab initio and density functional theory calculations for 1,5-methylnaphthalene.
    Nagabalasubramanian PB, Periandy S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Dec 01; 77(5):1099-107. PubMed ID: 20933463
    [Abstract] [Full Text] [Related]

  • 8. The molecular structure and vibrational spectra of 3-acetyl-4-[N-(2'-aminopyridinyl)-3-amino]-3-buten-2-one by Hartree-Fock and density functional theory calculations.
    Feki H, Fourati N, Abid Y, Minot C.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Aug 01; 67(5):1201-5. PubMed ID: 17113822
    [Abstract] [Full Text] [Related]

  • 9. Experimental and density functional theory and ab initio Hartree-Fock study on the vibrational spectra of 2-(4-fluorobenzylideneamino)-3-mercaptopropanoic acid.
    Ye Y, Ruan M, Song Y, Li YY, Xie W.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Sep 01; 68(1):85-93. PubMed ID: 17267274
    [Abstract] [Full Text] [Related]

  • 10. Comparison of experimental and density functional study on the molecular structure, infrared and Raman spectra and vibrational assignments of 6-chloronicotinic acid.
    Karabacak M, Kurt M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec 01; 71(3):876-83. PubMed ID: 18358772
    [Abstract] [Full Text] [Related]

  • 11. 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 01; 67(3-4):830-6. PubMed ID: 17018261
    [Abstract] [Full Text] [Related]

  • 12. Spectroscopic analysis and DFT calculations of a food additive carmoisine.
    Snehalatha M, Ravikumar C, Hubert Joe I, Sekar N, Jayakumar VS.
    Spectrochim Acta A Mol Biomol Spectrosc; 2009 Apr 01; 72(3):654-62. PubMed ID: 19124271
    [Abstract] [Full Text] [Related]

  • 13. Vibrational spectra and assignments of 5-amino-2-chlorobenzoic acid by ab initio Hartree-Fock and density functional methods.
    Sundaraganesan N, Joshua BD, Settu K.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Feb 01; 66(2):381-8. PubMed ID: 16843714
    [Abstract] [Full Text] [Related]

  • 14. 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 01; 68(3):771-7. PubMed ID: 17433769
    [Abstract] [Full Text] [Related]

  • 15. 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 01; 72(4):783-8. PubMed ID: 19112045
    [Abstract] [Full Text] [Related]

  • 16. Analysis of vibrational spectra of 4-amino-2,6-dichloropyridine and 2-chloro-3,5-dinitropyridine based on density functional theory calculations.
    Krishnakumar V, Dheivamalar S, Xavier RJ, Balachandran V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Sep 01; 65(1):147-54. PubMed ID: 16330246
    [Abstract] [Full Text] [Related]

  • 17. Quantum chemical determination of molecular geometries and interpretation of FTIR and Raman spectra for 2,4,5- and 3,4,5-tri-fluoro-benzonitriles.
    Mukherjee V, Singh K, Singh NP, Yadav RA.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec 15; 71(4):1571-80. PubMed ID: 18693066
    [Abstract] [Full Text] [Related]

  • 18. FTIR and FTRaman spectroscopic investigation of 2-bromo-4-methylaniline using ab initio HF and DFT calculations.
    Ramalingam S, Periandy S, Narayanan B, Mohan S.
    Spectrochim Acta A Mol Biomol Spectrosc; 2010 Jun 15; 76(1):84-92. PubMed ID: 20335064
    [Abstract] [Full Text] [Related]

  • 19. 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]

  • 20. Molecular structure and vibrational spectra of o-chlorotoluene, m-chlorotoluene, and p-chlorotoluene by ab initio HF and DFT calculations.
    Wang J, Ren M, Wang S, Qu Y.
    Spectrochim Acta A Mol Biomol Spectrosc; 2011 Mar 01; 78(3):1126-32. PubMed ID: 21227744
    [Abstract] [Full Text] [Related]

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