Computational study of conformations and of sulfinyl oxygen-induced pentacoordination at silicon in 4-chloro-4-silathiacyclohexane 1-oxide and 4,4-dichloro-4-silathiacyclohexane 1-oxide

Journal of Organometallic Chemistry

Volumn 690, Issue 18, 2005, Pages 4103-4113

  Freeman, Fillmore ^a   Entezam, Behrooz ^a   Gomarooni, Faranak ^a   Welch, Timothy S ^a   Shainyan, Bagrat A ^b  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b A E FAVORSKY IRKUTSK INSTITUTE OF CHEMISTRY   (Russian Federation)

Author keywords

Atomic charge; Conformational free energy; Pentacoordinated (trigonal bipyramidal) silicon; Transannular sulfinyl oxygen silicon coordination; Transition state

Indexed keywords

BONDING; CONFORMATIONS; OXYGEN; PROBABILITY DENSITY FUNCTION; SILICON;

ATOMIC CHARGE; CONFORMATIONAL FREE ENERGY; PENTACOORDINATED (TRIGONAL BIPYRAMIDAL) SILICON; TRANSANNULAR SULFINYL OXYGEN-SILICON COORDINATION; TRANSITION STATE;

ORGANIC COMPOUNDS;

EID: 25144466596     PISSN: 0022328X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jorganchem.2005.06.013     Document Type: Article

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