The halogen bond in thiirane···ClF: an example of a Mulliken inner complex.

نویسنده

  • J Grant Hill
چکیده

The halogen bond in the thiirane···ClF complex is shown to be unusually strong using high-accuracy ab initio methods. Investigating the underlying mechanism of the interaction reveals a significant increase in charge transfer and suggests it should be labelled as a Mulliken inner complex.

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عنوان ژورنال:
  • Physical chemistry chemical physics : PCCP

دوره 16 36  شماره 

صفحات  -

تاریخ انتشار 2014