Quantum chemical studies on some seleanaphthalene derivatives

Turker, L

doi:10.1016/j.saa.2004.07.025

Quantum chemical studies on some seleanaphthalene derivatives

INDIAN JOURNAL OF CHEMISTRY SECTION A-INORGANIC BIO-INORGANIC PHYSICAL THEORETICAL & ANALYTICAL CHEMISTRY, cilt.44, sa.4, ss.657-660, 2005 (SCI-Expanded)

Yayın Türü: Makale / Tam Makale
Cilt numarası: 44 Sayı: 4
Basım Tarihi: 2005
Doi Numarası: 10.1016/j.saa.2004.07.025
Dergi Adı: INDIAN JOURNAL OF CHEMISTRY SECTION A-INORGANIC BIO-INORGANIC PHYSICAL THEORETICAL & ANALYTICAL CHEMISTRY
Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
Sayfa Sayıları: ss.657-660
Orta Doğu Teknik Üniversitesi Adresli: Hayır

Özet

Quantum chemical studies on certain selenanaphthalene derivatives (having a keto or enol group and also Se atom in five- or six-membered ring system fused with naphthalene moiety) have been carried out using PM3 method at the level of restricted Hartree-Fock approach. The aquated systems have also been considered.