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. Author manuscript; available in PMC: 2011 Jun 7.
Published in final edited form as: Inorg Chem. 2010 Jun 7;49(11):5303–5315. doi: 10.1021/ic100411p

Figure 8.

Figure 8

The molecular orbitals that contribute to the main electronic absorption bands for both the exo (left) and the endo (right) conformers. Arrows indicate calculated electronic transitions. Molecular orbital surfaces are shown with contour values of 0.02 a.u.