A COMPUTATIONAL STUDY ON SOME SELENIUM-CONTAINING NAPHTHALENE DERIVATIVES

Date

2009-01-01

Author

Türker, Burhan Lemi

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A quantum chemical study, based on DFT theory is presented which considers certain selenium-containing naphthalene derivatives, including a keto group together with a Se atom embedded in either a five- or six-membered ring fused with naphthalene moiety. The corresponding enol structures also are considered. The quantum chemical and IR data collected are analyzed and NICS(0) values have been obtained.

Subject Keywords

Organic Chemistry, Materials Chemistry, Polymers and Plastics

URI

https://hdl.handle.net/11511/56836

Journal

POLYCYCLIC AROMATIC COMPOUNDS

DOI

https://doi.org/10.1080/10406630903454844

Collections

Department of Chemistry, Article

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Citation Formats

B. L. Türker, “A COMPUTATIONAL STUDY ON SOME SELENIUM-CONTAINING NAPHTHALENE DERIVATIVES,” POLYCYCLIC AROMATIC COMPOUNDS, pp. 315–332, 2009, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/56836.