Vibrational frequencies and structure of cyclopropenone from ab initio calculations

Journal of Molecular Structure

Volumn 695-696, Issue , 2004, Pages 339-343

  Yang, Juan ^a   McCann, Kathleen ^a   Laane, Jaan ^a  

^a TEXAS A AND M UNIVERSITY   (United States)

Author keywords

Ab initio calculations; Cyclopropenone; Vibrational coupling; Vibrational spectra

Indexed keywords

CYCLOPROPENONE; KETONE DERIVATIVE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CHEMICAL BOND; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; QUANTITATIVE ANALYSIS; STRUCTURE ANALYSIS; VIBRATION;

EID: 2542449319     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2003.12.046     Document Type: Article

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