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Title: The frontier molecular orbital analysis of the phosphorus analogues of cyclopeqtadienyl anion
Authors: Malar, E J Padma
Issue Date: Feb-1994
Publisher: NISCAIR-CSIR, India
Abstract: Quantum chemical calculations at· the semiempirical level reveal that in the phosphorus analogues of cyclopentadienyl anion having three or more in-ring phosphorus atoms, there is a marked lowering of the π* levels as compared to the lowering ofthe highest occupied π levels. This leads to the possibility of having significant interactions between the vacant π* orbitals of these species with the occupied orbitals of other substrates.
Page(s): 143-144
ISSN: 0975-0975(Online); 0376-4710(Print)
Appears in Collections:IJC-A Vol.33A(02) [February 1994]

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