DFT and NBO theoretical study of protonation of tri-tert-butoxysilanethiol and its anion

Polyhedron

Volumn 27, Issue 3, 2008, Pages 969-976

  Chojnacki, Jarosław ^a  

^a GDANSK UNIVERSITY OF TECHNOLOGY   (Poland)

Author keywords

DFT; Natural bond orbital analysis; Protonation; Silanethiols; Silicon sulfur compounds

Indexed keywords

BOND LENGTH; C (PROGRAMMING LANGUAGE); OXYGEN; PROTONATION; SILICON COMPOUNDS; SULFUR COMPOUNDS;

DENSITY-FUNCTIONAL THEORY CALCULATIONS; DENSITY-FUNCTIONAL-THEORY; GEOMETRY OPTIMIZATION; NATURAL BOND ORBITAL; NATURAL BOND ORBITAL ANALYSIS; PROTONATIONS; SI-S BONDS; SILANETHIOL; SILICON-SULPHUR COMPOUND; THEORETICAL STUDY;

DENSITY FUNCTIONAL THEORY;

EID: 38749125102     PISSN: 02775387     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.poly.2007.11.041     Document Type: Article

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