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. Author manuscript; available in PMC: 2009 Jul 29.
Published in final edited form as: J Org Chem. 2008 Aug 2;73(17):6480–6488. doi: 10.1021/jo8008534

FIGURE 5.

FIGURE 5

Modeled structure (HyperChem; MM+ force field) of DABCO bound by H2a. Ethyl groups have been truncated or shown as methyl groups, and one cavitand wall has been removed for clarity. The acid proton (shown in white, CPK style) has been transferred to DABCO, consistent with TOCSY measurements.