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HeI Photoelectron Spectra and Gas-phase Electronic Structures of End-functionalized [3]- and [5]-Ladderanes

[3]- and [5]-ladderanes obtained by way of template-controlled syntheses conducted in the organic solid state have been characterized Via He I photoelectron (PE) spectroscopy. The results provide a first correlation with X-ray crystallographic structure data and establish the reliability of quantum chemical DFT (B3LYP/6-31G*) and ab initio HF calculations in predicting geometrical and electronic structures of molecular ladder frameworks.

[3]-and [5]-ladderanes ; photoelectron spectra ; electronic structure

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