Chair, boat and twist conformation of dodecamethylcyclohexasilane and undecamethylcyclohexasilane: A combined DFT and raman spectroscopic study

ChemPhysChem

Volumn 7, Issue 2, 2006, Pages 421-429

  Tekautz, Günter ^a   Binter, Alexandra ^a   Hassler, Karl ^a   Flock, Michaela ^a  

^a GRAZ UNIVERSITY OF TECHNOLOGY   (Austria)

Author keywords

Ab initio calculations; Conformation analysis; Cyclohexasilanes; Raman spectroscopy

Indexed keywords

ATOMS; BOATS; CALCULATIONS; HYDROGEN; RAMAN SCATTERING; RAMAN SPECTROSCOPY; SPECTROSCOPIC ANALYSIS; TEMPERATURE; VIBRATIONS (MECHANICAL);

AB INITIO CALCULATIONS; B3LYP DENSITY FUNCTIONAL; CONFORMATION ANALYSIS; CYCLOHEXASILANES; INCREASING TEMPERATURES; INTERCONVERSION BARRIERS; RAMAN SPECTROSCOPIC STUDY; TRANSITION STRUCTURES;

SILICON COMPOUNDS;

EID: 32944461073     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.200500417     Document Type: Article

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