A theoretical study on the coordination behavior of some phosphoryl, carbonyl and sulfoxide derivatives in lanthanide complexation.

Gholivand, Khodayar; Kahnouji, Mohammad; Maghsoud, Yazdan; Masumian, Ehsan; Hosseini, Mahdieh

Gholivand, Khodayar; Kahnouji, Mohammad; Maghsoud, Yazdan; Masumian, Ehsan; Hosseini, Mahdieh.

Afiliação

Gholivand K; Department of Chemistry, Faculty of Science, Tarbiat Modares University, Tehran, Iran. gholi_kh@modares.ac.ir.
Kahnouji M; Department of Chemistry, Faculty of Science, Tarbiat Modares University, Tehran, Iran.
Maghsoud Y; Department of Chemistry, Faculty of Science, Tarbiat Modares University, Tehran, Iran.
Masumian E; Department of Chemistry, Faculty of Science, Tarbiat Modares University, Tehran, Iran.
Hosseini M; Department of Chemistry, Faculty of Science, Tarbiat Modares University, Tehran, Iran.

J Mol Model ; 24(11): 328, 2018 Oct 29.

Article em En | MEDLINE | ID: mdl-30374628

Palavras-chave

AIM; DFT calculation; EDA; Lanthanide complex; NBO analysis

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Texto completo: 1 Base de dados: MEDLINE Idioma: En Revista: J Mol Model Assunto da revista: BIOLOGIA MOLECULAR Ano de publicação: 2018 Tipo de documento: Article País de afiliação: Irã

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