How does ammonium interact with aromatic groups? A density functional theory (DFT/B3LYP) investigation

Journal of Physical Chemistry A

Volumn 104, Issue 42, 2000, Pages 9573-9580

  Zhu, Wei Liang ^a,b   Tan, Xiao Jian ^b   Puah, Chum Mok ^a   Gu, Jian De ^b   Jiang, Hua Liang ^b,c   Chen, Kai Xian ^b   Felder, Clifford E ^c   Silman, Israel ^c   Sussman, Joel L ^c  

^a SINGAPORE POLYTECHNIC   (Singapore)

^b SHANGHAI INSTITUTE OF MATERIA MEDICA   (China)

^c WEIZMANN INSTITUTE OF SCIENCE   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

AMMONIA; AROMATIC COMPOUNDS; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; REACTION KINETICS;

DENSITY FUNCTIONAL THEORY (DFT);

DRUG INTERACTIONS;

EID: 0034295617     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp001306v     Document Type: Article

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