He Jin, Chen Fan, Li Jun, Sankey Otto F, Terazono Yuichi, Herrero Christian, Gust Devens, Moore Thomas A, Moore Ana L, Lindsay Stuart M
Department of Physics and Astronomy, Department of Chemistry and Biochemistry, and Biodesign Institute, Arizona State University, Tempe, AZ 85287, USA.
J Am Chem Soc. 2005 Feb 9;127(5):1384-5. doi: 10.1021/ja043279i.
The conductance of carotenoid polyenes chemically bound at each end to gold contacts has been measured for single molecules containing 5, 7, 9, and 11 carbon-carbon double bonds in conjugation. The electronic decay constant, beta, is determined to be 0.22 +/- 0.04 A-1, in close agreement with the value obtained from first principles simulations (0.22 +/- 0.01 A-1). The absolute values of the molecular conductance are within a factor of 3 of those calculated from first principles. The small value of beta demonstrates that conductivity drops off only slowly with chain length, confirming that carotenoid conjugated chains are relatively good molecular "wires".