Stable structures of 12-crown-O3N complexes with Li+ or Na+ in aqueous and acetonitrile solutions

Tetrahedron

Volumn 60, Issue 48, 2004, Pages 10877-10882

  Okano, Katsuhiko ^a   Tsukube, Hiroshi ^b   Hori, Kenzi ^c  

^a DAIICHI SANKYO CO   (Japan)

^b Osaka Prefecture University   (Japan)

^c YAMAGUCHI UNIVERSITY   (Japan)

Author keywords

12 Crown O3N; Ab initio molecular orbital calculations; Monte Carlo simulation; Stable conformations in solution

Indexed keywords

ACETONITRILE; ALKALI METAL; CROWN ETHER DERIVATIVE; LITHIUM ION; METAL ION; NITROGEN; SODIUM DERIVATIVE; SOLVENT;

AQUEOUS SOLUTION; ARTICLE; CHEMICAL STRUCTURE; MOLECULAR STABILITY; MONTE CARLO METHOD; PRIORITY JOURNAL; QUANTUM MECHANICS; STRUCTURE ANALYSIS;

EID: 14344259797     PISSN: 00404020     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.tet.2004.09.041     Document Type: Article

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