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Question

Physical Chemistry Question on Molecular structure and Chemical bonding

Ψ1, Ψ2, Ψ3 and Ψ4 are four Hückel molecular orbitals of benzene with orbital energies E1, E2, E3, and E4, respectively.
Ψ1 = 12\frac{1}{2}(ФB + ФC - ФE - ФF)
Ψ2 = 6126^{-\frac{1}{2}}(ФA - ФB + ФC - ФD + ФE - ФF)
Ψ3 = 6126^{-\frac{1}{2}}(ФA + ФB + ФC + ФD + ФE - ФF)
Ψ4 = 121212^{-\frac{1}{2}}(2ФA + ФB - ФC - 2ФD - ФE + ФF)
The correct order of the orbital energies is
(The six carbon atoms of benzene are denoted by A to F and ФJ, is the 2pz, orbital of Jth carbon of benzene.)

A

E1 < E2 = E3 < E4

B

E4 < E1 = E3 < E2

C

E3 < E1 = E4 < E2

D

E3 < E2 < E1 = E4

Answer

E3 < E1 = E4 < E2

Explanation

Solution

The correct option is (C) : E3 < E1 = E4 < E2.