Skip to main content
. Author manuscript; available in PMC: 2010 Jun 3.
Published in final edited form as: J Am Chem Soc. 2009 Jun 3;131(21):7402–7410. doi: 10.1021/ja900766b

Figure 12.

Figure 12

Minimized representations of two conformers of one enantiomer of 1,5-epoxyalcohol 2 in a simplified model of cavitand 1 (Spartan ’04, PM3 level of theory). Left: CPK/tube models show the distinct axial/equatorial disposition of the methyl groups. Right: a different view displaying the solvent-accessible surface (1.4 Å probe) of the host (the front aromatic wall is omitted for clarity).