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Journal Abstract Search

332 related items for PubMed ID: 16682250

  • 1. The molecular structure and vibrational spectra of 1-amino-5-benzoyl-4-phenylpyrimidin-2(1H) by Hartree-Fock and density functional methods.
    Atalay Y, Yakuphanoglu F, Sekerci M.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Nov; 65(3-4):964-8. PubMed ID: 16682250
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  • 2. 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; 67(5):1201-5. PubMed ID: 17113822
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  • 3. Theoretical studies of molecular structure and vibrational spectra of melaminium citrate.
    Atalay Y, Avci D.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jun; 67(2):327-33. PubMed ID: 16965934
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  • 4. A theoretical study on 1-(thiophen-2-yl-methyl)-2-(thiophen-2-yl)-1H-benzimidazole.
    Sekerci M, Atalay Y, Yakuphanoglu F, Avci D, Başoğlu A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jun; 67(2):503-8. PubMed ID: 17142090
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  • 5. Theoretical studies of molecular structure and vibrational spectra of 2-amino-5-phenyl-1,3,4-thiadiazole.
    Atalay Y, Yakuphanoglu F, Sekerci M, Avci D, Başoğlu A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 May 01; 64(1):68-72. PubMed ID: 16095959
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  • 6. Vibrational spectra and molecular structure of chiral and racemic 4-phenyl-1,3-oxazolidin-2-one by density functional theory and ab initio Hartree-Fock calculations.
    Atalay Y, Ucun F, Avci D, Başoğlu A.
    Spectrochim Acta A Mol Biomol Spectrosc; 2006 Jun 01; 64(3):549-54. PubMed ID: 16442841
    [Abstract] [Full Text] [Related]

  • 7. Theoretical studies of molecular structure and vibrational spectra of O-ethyl benzoylthiocarbamate.
    Arslan H, Flörke U, Külcü N.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jul 01; 67(3-4):936-43. PubMed ID: 17049302
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  • 8. Density functional theory study on the structure and vibrational frequencies of glycylglycine.
    Zhao B, Wang C, Zhao S, Qin M, Zhou Z, Sun Y.
    Spectrochim Acta A Mol Biomol Spectrosc; 2008 Jul 01; 70(2):301-6. PubMed ID: 17919969
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  • 9. The molecular structure and vibrational spectra of 2-chloro-N-(diethylcarbamothioyl)benzamide by Hartree-Fock and density functional methods.
    Arslan H, Flörke U, Külcü N, Binzet G.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Dec 31; 68(5):1347-55. PubMed ID: 17418631
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  • 12. Molecular structures and vibrational frequencies of xanthine and its methyl derivatives (caffeine and theobromine) by ab initio Hartree-Fock and density functional theory calculations.
    Ucun F, Sağlam A, Güçlü V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Jun 31; 67(2):342-9. PubMed ID: 16942910
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  • 13. 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 31; 72(5):1076-83. PubMed ID: 19213598
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