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Public Documents
1
Theoretical Studies on How to Tune the π-hole Pnicogen Bonds by Substitution and Coop...
Lijuan Zhang
and 1 more
July 31, 2020
A systemic investigation of the substitution and cooperative effects on the P…N π-hole pnicogen bond were performed via theoretical calculations. The structural and energetic properties of the binary complexes between a series of substituted benzonitrile and PO2F have been examined to study the substitution effect. The stability of the binary complexes increases in the order of CN
