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Title: UPS study of intramolecular interactions
Authors: Novak, I. 
Kovač, B.
Issue Date: Feb-2001
Citation: Novak, I., Kovač, B. (2001-02). UPS study of intramolecular interactions. Journal of Electron Spectroscopy and Related Phenomena 113 (2-3) : 175-177. ScholarBank@NUS Repository.
Abstract: HeI photoelectron spectra (UPS) of pyrazabole and cubane-1,4-dicarboxylic acid dimethyl ester were recorded and analyzed using semi-empirical calculations. The efficiency of BH2 fragment in relaying interactions between pyrazole rings was determined. The cubane ester was studied because of possible through-bond interactions between carboxyl groups relayed via the rigid cubane skeleton. The energies of orbitals associated with COOMe group fall within the energy level gap between t2g+t2u and eg manifolds in cubane and it is interesting to determine which mechanism is operational for COOMe-COOMe interactions.
Source Title: Journal of Electron Spectroscopy and Related Phenomena
ISSN: 03682048
DOI: 10.1016/S0368-2048(00)00422-9
Appears in Collections:Staff Publications

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