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Probing Halogen-π versus CH-π Interactions in Molecular Balance.

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Molecular balances based on the dibenzobicyclo[3.2.2]nonane template enable probing of the competition between halogen-π and CH-π interactions. Structural, NMR spectroscopic, and computational analyses revealed that the π system can favorably… Click to show full abstract

Molecular balances based on the dibenzobicyclo[3.2.2]nonane template enable probing of the competition between halogen-π and CH-π interactions. Structural, NMR spectroscopic, and computational analyses revealed that the π system can favorably interact both with C-X or C-H functionalities, depending on the size of the functional group.

Keywords: versus interactions; molecular balance; probing halogen; halogen; halogen versus; interactions molecular

Journal Title: Organic letters
Year Published: 2020

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