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Q.(i) What is bond order according to M.O. theory ?

(1)
(ii) He2 molecule does not exist, why ? (2)
Kerala DhseKerala DHSE Plus One Board 2021Subjective· 3mImportance★★★★★
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Molecular Orbital theory defines bond order from the electron populations of bonding vs antibonding MOs, and a bond order of zero means no stable bond can form.

(i) According to Molecular Orbital (MO) theory, the bond order of a molecule/ion is defined as:

Bond order = 1/2 (Nb - Na)

where Nb is the number of electrons occupying bonding molecular orbitals and Na is the number of electrons occupying antibonding molecular orbitals. A higher bond order generally means a stronger, shorter bond; a bond order of zero means the species cannot exist as a stable molecule.

(ii) He2 has 2 + 2 = 4 electrons total. Filling the MOs in order of energy: sigma1s^2 sigma1s^2. That is, 2 electrons go into the bonding sigma1s orbital (Nb = 2) and 2 electrons go into the antibonding sigma1s orbital (Na = 2).

Bond order = 1/2 (Nb - Na) = 1/2 (2 - 2) = 0 …

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