Dative versus electron-sharing bonding in N-imides and phosphane imides R3ENX and relative energies of the R2EN(X)R isomers (E = N, P; R = H, Cl, Me, Ph; X = H, F, Cl)*
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DOI: 10.1080/00268976.2018.1542166
Abstract: ABSTRACT Quantum chemical calculations using density functional theory BP86 and M06-2X functionals in conjunction with def2-TZVPP basis sets have been carried out on the title molecules. The calculation results reveal that the N-imides R3NNX are… read more here.
Keywords: phosphane imides; energy; bond; electron sharing ... See more keywords