Hydronium ion complex of 18-crown-6: Theory confirms three "normal" linear hydrogen bonds

Journal of Physical Chemistry A

Volumn 108, Issue 51, 2004, Pages 11463-11468

  Bühl, Michael ^a   Ludwig, Ralf ^b   Schurhammer, Rachel ^c   Wipff, Georges ^a,b,c  

^a MAX PLANCK INSTITUT FÜR KOHLENFORSCHUNG   (Germany)

^b UNIVERSITY OF ROSTOCK   (Germany)

^c UNIVERSITÉ LOUIS PASTEUR   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BIFURCATION (MATHEMATICS); COMPLEXATION; COMPUTATIONAL METHODS; HYDROGEN BONDS; INFRARED SPECTROSCOPY; POSITIVE IONS; PROBABILITY DENSITY FUNCTION;

HYBRID FUNCTIONALS; ROTATIONAL MOBILITY; SOLVATION; VIBRATIONAL FREQUENCIES;

HYDROGEN;

EID: 84961986857     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp045879     Document Type: Article

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