A New Polymorph of 5-Fluorouracil Found Following Computational Crystal Structure Predictions
收藏NIAID Data Ecosystem2026-03-06 收录
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A new polymorph of 5-fluorouracil has been obtained following a manual polymorph screen inspired by a computational crystal structure prediction search. It corresponds to the structure that was predicted to be the global minimum in lattice energy. The difficulty of crystallizing this simple structure with a rational hydrogen-bonding motif can be rationalized from the differential solvation of the functional groups.
创建时间：
2016-05-06
