Unimolecular Reaction Pathways of a Î³-Ketohydroperoxide from Combined Application of Automated Reaction Discovery Methods.

Grambow, Colin A; Jamal, Adeel; Li, Yi-Pei; Green, William H; Zádor, Judit; Suleimanov, Yury V

Grambow, Colin A; Jamal, Adeel; Li, Yi-Pei; Green, William H; Zádor, Judit; Suleimanov, Yury V.

Affiliation

Grambow CA; Department of Chemical Engineering, Massachusetts Institute of Technology , 77 Massachusetts Ave., Cambridge, Massachusetts 02139, United States.
Jamal A; Department of Chemical Engineering, Massachusetts Institute of Technology , 77 Massachusetts Ave., Cambridge, Massachusetts 02139, United States.
Li YP; Department of Chemical Engineering, Massachusetts Institute of Technology , 77 Massachusetts Ave., Cambridge, Massachusetts 02139, United States.
Green WH; Department of Chemical Engineering, Massachusetts Institute of Technology , 77 Massachusetts Ave., Cambridge, Massachusetts 02139, United States.
Zádor J; Combustion Research Facility, Sandia National Laboratories , 7011 East Ave., Livermore, California 94551, United States.
Suleimanov YV; Computation-based Science and Technology Research Center, Cyprus Institute , 20 Kavafi Str., Nicosia 2121, Cyprus.

J Am Chem Soc ; 140(3): 1035-1048, 2018 01 24.

Article de En | MEDLINE | ID: mdl-29271202

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Texte intégral: 1 Collection: 01-internacional Base de données: MEDLINE Langue: En Journal: J Am Chem Soc Année: 2018 Type de document: Article Pays d'affiliation: États-Unis d'Amérique Pays de publication: États-Unis d'Amérique

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