Vibrational assignment of isoxazole aided by rovibrational data and density functional theory

Journal of Molecular Spectroscopy

Volumn 231, Issue 1, 2005, Pages 50-56

  Robertson, Evan G ^a  

^a MONASH UNIVERSITY   (Australia)

Author keywords

Anharmonic potential; Density functional theory; Inertial defect; IR spectroscopy; Isoxazole; Raman spectroscopy; Rovibrational analysis

Indexed keywords

DATA ACQUISITION; DERIVATIVES; HARMONIC ANALYSIS; INFRARED SPECTROSCOPY; MOLECULAR VIBRATIONS; PROBABILITY DENSITY FUNCTION; RAMAN SPECTROSCOPY;

ANHARMONIC POTENTIAL; INERTIAL DEFECTS; ISOXAZOLE; ROVIBRATIONAL ANALYSIS;

ORGANIC COMPOUNDS;

EID: 15844391638     PISSN: 00222852     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jms.2005.01.002     Document Type: Article

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