The spectroscopic (FT-IR and FT-Raman) and theoretical studies of 5-bromo-salicylic acid

Journal of Molecular Structure

Volumn 919, Issue 1-3, 2009, Pages 215-222

  Karabacak, Mehmet ^a   Kurt, Mustafa ^b  

^a AFYON KOCATEPE UNIVERSITY   (Turkey)

^b AHI EVRAN UNIVERSITY   (Turkey)

Author keywords

5 Bromo salicylic acid; DFT; IR and Raman spectra; Molecular structure; Vibrational frequencies

Indexed keywords

ACIDS; HYDROGEN; HYDROGEN BONDS; INFRARED SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULES; PROBABILITY DENSITY FUNCTION; QUANTUM CHEMISTRY; QUANTUM THEORY; RAMAN SCATTERING; RAMAN SPECTROSCOPY;

5-BROMO-SALICYLIC ACID; BASIS SETS; BOND ANGLES; COMPUTATIONAL RESULTS; DFT; FOURIER TRANSFORM INFRARED SPECTRUM; FT-RAMAN; GEOMETRICAL PARAMETERS; INFRARED INTENSITIES; IR AND RAMAN SPECTRA; QUANTUM CHEMICAL CALCULATIONS; RAMAN SPECTRUM; SCALED QUANTUM MECHANICS; SINGLE BONDS; SOLID-PHASE; STABLE CONFORMERS; THEORETICAL RESULTS; THEORETICAL STUDIES; TOTAL ENERGY DISTRIBUTIONS; VIBRATIONAL FREQUENCIES; VIBRATIONAL MODES;

FOURIER TRANSFORMS;

EID: 59149107436     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2008.09.012     Document Type: Article

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