000 01358 a2200361 4500
005 20250515003717.0
264 0 _c20060619
008 200606s 0 0 eng d
022 _a0022-3263
024 7 _a10.1021/jo0502706
_2doi
040 _aNLM
_beng
_cNLM
100 1 _aSeckute, Jolita
245 0 0 _aAb initio molecular orbital and density functional studies on the solvolysis of sarin and O,S-dimethyl methylphosphonothiolate, a VX-like compound.
_h[electronic resource]
260 _bThe Journal of organic chemistry
_cOct 2005
300 _a8649-60 p.
_bdigital
500 _aPublication Type: Journal Article; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, Non-P.H.S.
650 0 4 _aAlkalies
650 0 4 _aComputational Biology
650 0 4 _aHydrolysis
650 0 4 _aHydroxides
_xchemistry
650 0 4 _aModels, Molecular
650 0 4 _aMolecular Conformation
650 0 4 _aOrganothiophosphorus Compounds
_xchemistry
650 0 4 _aOxidation-Reduction
650 0 4 _aSarin
_xchemistry
650 0 4 _aSolubility
700 1 _aMenke, Jessica L
700 1 _aEmnett, Ryan J
700 1 _aPatterson, Eric V
700 1 _aCramer, Christopher J
773 0 _tThe Journal of organic chemistry
_gvol. 70
_gno. 22
_gp. 8649-60
856 4 0 _uhttps://doi.org/10.1021/jo0502706
_zAvailable from publisher's website
999 _c15866234
_d15866234