Molecular Structures of Isomeric Ortho, Meta, and Para Bromo-Substituted &#945;-Methylsulfonyl-&#945;-diethoxyphosphoryl Acetophenones by X-ray and DFT Molecular Orbital Calculations.

Rodrigues, Alessandro; Olivato, Paulo R; Zukerman-Schpector, Julio; Maganhi, Stella H; Reis, Adriana K C A; Tiekink, Edward R T

Molecular Structures of Isomeric Ortho, Meta, and Para Bromo-Substituted α-Methylsulfonyl-α-diethoxyphosphoryl Acetophenones by X-ray and DFT Molecular Orbital Calculations.

Rodrigues, Alessandro; Olivato, Paulo R; Zukerman-Schpector, Julio; Maganhi, Stella H; Reis, Adriana K C A; Tiekink, Edward R T.

Afiliação

Rodrigues A; Institute for Environmental, Chemical and Pharmaceutical Sciences, Federal University of São Paulo, UNIFESP, Diadema 09972-270, SP Brazil.
Olivato PR; Institute of Chemistry, University of São Paulo, USP, CP 26077, 05513-970 São Paulo, SP Brazil.
Zukerman-Schpector J; §Department of Chemistry, Federal University of São Carlos, CP 676, 13565-905 São Carlos, SP Brazil.
Maganhi SH; §Department of Chemistry, Federal University of São Carlos, CP 676, 13565-905 São Carlos, SP Brazil.
Reis AK; Institute for Environmental, Chemical and Pharmaceutical Sciences, Federal University of São Paulo, UNIFESP, Diadema 09972-270, SP Brazil.
Tiekink ER; â¥Department of Chemistry, University of Malaya, Kuala Lumpur 50603, Malaysia.

J Phys Chem A ; 119(32): 8714-23, 2015 Aug 13.

Article em En | MEDLINE | ID: mdl-26213179

Assuntos

Acetofenonas/química; Gases/química; Modelos Químicos; Estrutura Molecular; Teoria Quântica; Raios X

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Acetofenonas Idioma: En Revista: J Phys Chem A Assunto da revista: QUIMICA Ano de publicação: 2015 Tipo de documento: Article

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