Direct Imaging of Covalent Bond Structure in Single-Molecule Chemical Reactions

Science 340, 1434 - 1437 (2013)

Direct Imaging of Covalent Bond Structure in Single-Molecule Chemical Reactions

Dimas G. de Oteyza, Patrick Gorman, Yen-Chia Chen, Sebastian Wickenburg, Alexander Riss, Duncan J. Mowbray, Grisha Etkin, Zahra Pedramrazi, Hsin-Zon Tsai, Angel Rubio, Michael F. Crommie, Felix R. Fischer

Observing the intricate chemical transformation of an individual molecule as it undergoes a complex reaction is a longstanding challenge in molecular imaging. Advances in scanned probe microscopy now provide the tools to visualize not only the frontier orbitals of chemical reaction partners and products, but their internal covalent bond configurations as well. Here we demonstrate the use of noncontact atomic force microscopy to investigate reaction-induced changes in the detailed internal bond structure of individual oligo-(phenylene-1,2-ethynylenes) on Ag(100) as they undergo a series of cyclization processes. Our images reveal the complex surface reaction mechanisms underlying thermally induced cyclization cascades of enediynes. Additional evidence for the proposed reaction pathways is obtained using ab initio density functional theory.

Additional Information

Doi
http://dx.doi.org/10.1126/science.1238187
More Information
http://www.sciencemag.org/content/340/6139/1417.summary
Notes
PERSPECTIVE CHEMISTRY Seeing the Reaction Franz J. Giessibl Science 21 June 2013: 1417-1418.

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