Theoretical proton affinity and fluoride affinity of nerve agent VX

Journal of Physical Chemistry A

Volumn 114, Issue 50, 2010, Pages 13189-13197

  Bera, Narayan C ^a   Maeda, Satoshi ^a   Morokuma, Keiji ^a   Viggiano, Al A ^b  

^a EMORY UNIVERSITY   (United States)

^b AIR FORCE RESEARCH LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALKYL GROUPS; HYDROGEN ATOMS; ION-MOLECULE COMPLEXES; NERVE AGENTS; PROTON AFFINITY; PROTONATED; SULFUR ATOMS; SURROGATE SYSTEMS;

OXYGEN; PROTONATION; SULFUR;

PROTONS;

CHEMICAL WARFARE AGENT; FLUORIDE; METHANE; METHYLPHOSPHONOTHIOIC ACID S (2 DIISOPROPYLAMINOETHYL) O ETHYL ESTER; PHOSPHOROTHIOIC ACID DERIVATIVE; PROTON;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; MASS SPECTROMETRY; QUANTUM THEORY;

CHEMICAL WARFARE AGENTS; FLUORIDES; MASS SPECTROMETRY; METHANE; MODELS, MOLECULAR; MOLECULAR CONFORMATION; ORGANOTHIOPHOSPHORUS COMPOUNDS; PROTONS; QUANTUM THEORY;

EID: 78650413384     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp107718w     Document Type: Article

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