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Mesoionic imidazolylidenes are recognized as excellent electron‐donating ligands in organometallic and main group chemistry. However, these carbene ligands typically show poor π‐accepting properties. A computational analysis of 71 mesoionic imidazolylidenes that bear different aryl or heteroaryl substituents in C2 position was performed. The study has revealed that a diphenyltriazinyl (Dpt) substituent...
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