Theoretical Investigation of Steric Effect Influence on Reactivity of Substituted Butadienes with Bromocyclobutenone.

Adilakshmi, Arumugam; Deepan Kumar, Madhu; Jaccob, Madhavan; Tamilmani, Venkatachalam

Adilakshmi, Arumugam; Deepan Kumar, Madhu; Jaccob, Madhavan; Tamilmani, Venkatachalam.

Afiliação

Adilakshmi A; Department of Chemistry , University College of Engineering, Ariyalur (A Constituent College of Anna University-Chennai) , Ariyalur - 621704 , Tamil Nadu , India.
Deepan Kumar M; Computational Chemistry Laboratory, Loyola Institute of Frontier Energy (LIFE) and Department of Chemistry , Loyola College (Autonomous) , Chennai - 600 034 , Tamil Nadu , India.
Jaccob M; Computational Chemistry Laboratory, Loyola Institute of Frontier Energy (LIFE) and Department of Chemistry , Loyola College (Autonomous) , Chennai - 600 034 , Tamil Nadu , India.
Tamilmani V; Department of Chemistry , Bharathidasan Institute of Technology (A Constituent College of Anna University-Chennai) , Tiruchirappalli - 620 024 , Tamil Nadu , India.

J Chem Inf Model ; 59(5): 2231-2241, 2019 05 28.

Article em En | MEDLINE | ID: mdl-30920826

Assuntos

Butadienos/química; Ciclobutanos/química; Teoria da Densidade Funcional; Ligação de Hidrogênio; Modelos Moleculares; Conformação Molecular

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Butadienos / Ciclobutanos / Teoria da Densidade Funcional Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2019 Tipo de documento: Article

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