Structures and Thermodynamics of the Sul
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Yana Steudel; Ralf Steudel
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Article
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2003
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John Wiley and Sons
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English
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## Abstract At the G3(MP2) level of theory the __trans__ isomer 1a of the hypothetical molecule SF~4~(CN)~2~ is more stable than the __cis__ isomer 1b by 8 kJยทmol^โ1^. The isomerization of 1a to 1b requires an activation enthalpy of 319ย kJยทmol^โ1^ at 298ย K. The decomposition of __trans__โSF~4~(CN)~