Image:GlcA.jpeg

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[edit] Summary

This structure is the methyl glycoside of Glucuronic acid and was fully geometrically optimised using ab initio quantum mechanical calculations at the 6-31G* level with GAMESS. It is in the ⁴C₁ conformation and the cremer pople puckering parameters are as follows.

theta=4.69 phi2=27.83 Q=0.56

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