Vibrational assignments and electronic structure calculations for 6-thioguanine

Journal of Raman Spectroscopy

Volumn 40, Issue 11, 2009, Pages 1675-1681

  Gunasekaran, S ^a   Kumaresan, S ^b   Arunbalaji, R ^a   Anand, G ^b   Seshadri, S ^c   Muthu, S ^d  

^a PACHAIYAPPA S COLLEGE   (India)

^b Arulmigu Meenakshi Amman College of Engineering   (India)

^c SCSVMV UNIVERSITY   (India)

^d SRI VENKATESWARA COLLEGE OF ENGINEERING   (India)

Author keywords

Ab initio ZINDO and DFT; Thioguanine; Vibrational and electronic spectra

Indexed keywords

MOLECULAR ORBITALS; ORBITAL CALCULATIONS;

6-THIOGUANINE; AB INITIO; AB INITIO ZINDO AND DFT; DENSITY FUNCTIONAL COMPUTATIONS; ELECTRONIC STRUCTURE CALCULATIONS; FOURIER TRANSFORM INFRARED SPECTRA; FOURIER TRANSFORM RAMAN; THIOGUANINE; VIBRATIONAL AND ELECTRONIC SPECTRA; VIBRATIONAL ASSIGNMENT;

ELECTRONIC STRUCTURE;

EID: 70450169599     PISSN: 03770486     EISSN: 10974555     Source Type: Journal    
DOI: 10.1002/jrs.2318     Document Type: Article

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