Nature of the Carbon−Sulfur Bond in the Species H−CS−OH
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A QTAIM (Quantum-Theory-Atoms-in-Molecules) and ELF (electron localization function) topological analysis of the bonding in the recently reported molecule HCSX, X = OH reveals that the central carbon−sulfur bond is highly tunable, from having triple character at one limit to being almost a single bond at the other depending on the nature of the group X.
创建时间：
2016-02-24
