FT-IR, FT-Raman spectra, density functional computations of the vibrational spectra and molecular geometry of biomolecule 5-aminouracil

Chemical Physics

Volumn 340, Issue 1-3, 2007, Pages 17-31

  Alcolea Palafox, M ^a   Tardajos, G ^a   Guerrero Martinez A ^a   Rastogi, V K ^b   Mishra, D ^b   Ojha, S P ^b   Kiefer, W ^c  

^a UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

^b CH CHARAN SINGH UNIVERSITY   (India)

^c UNIVERSITY OF WÜRZBURG   (Germany)

Author keywords

5 Aminouracil; DFT; Dimer; Geometry optimization; IR and Raman spectra; Tautomers; Vibrational wavenumbers

Indexed keywords

EID: 35549009734     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2007.07.032     Document Type: Article

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