Yazarlar |
Dr. Öğr. Üyesi Fatemeh MOLLAAMIN
Kastamonu Üniversitesi, Türkiye |
Özet |
In this article, NMR shielding is investigated in the reactions of 1,3 dipolar cycloaddition of benzonitrile oxide with acrylonitrile, which have been recently studied [E. Rajaeian, M. Monajjem, Cholami, J. Chem. Res., s, 279, (2002); E. Rajaeian, M. Monajjem, Cholami, J. Chem. Res., s, 91, (2003)]. We reported 15N and 17O tensors for benzonitrile oxide and two products in reactions in gas phase and several various solvents and compared the effect of dielectric constant on tensors of the materials mentioned above. Also diffuse and polarizable function effects in basis set are investigated. |
Anahtar Kelimeler |
1,3 Dipolar cycloaddition | Chemical shielding tensor | NMR |
Makale Türü | Özgün Makale |
Makale Alt Türü | SCOPUS dergilerinde yayımlanan tam makale |
Dergi Adı | Physics and Chemistry of Liquids |
Dergi ISSN | 0031-9104 |
Dergi Tarandığı Indeksler | SCI-Expanded |
Makale Dili | İngilizce |
Basım Tarihi | 06-2008 |
Cilt No | 46 |
Sayı | 3 |
Sayfalar | 299 / 306 |
Doi Numarası | 10.1080/00319100601124369 |
Makale Linki | http://dx.doi.org/10.1080/00319100601124369 |