Electronic Structure of 11H-dibenz(b,f)azepines

Igor Novak, Leo Klasinc, Sean P. McGlynn

Research output: Contribution to journalArticlepeer-review

1 Citation (Scopus)

Abstract

The electronic structures and conformers of several 11H-Dibenz(b,f)azepines (DBA) have been studied by UV photoelectron spectroscopy (UPS) and quantum chemistry calculations. The main features of the electronic structure of DBA derivatives are discussed. The molecular structures of all the molecules studied are nonplanar with the central aza-cycloheptene ring in boat conformation. The keto derivative has the smallest deviation from planarity experienced of the aza-cycloheptene ring.
Original languageEnglish
Pages (from-to)56-61
Number of pages6
JournalJournal of Electron Spectroscopy and Related Phenomena
Volume212
DOIs
Publication statusPublished - 2016

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