Question
Chemistry Question on Chemical bonding and molecular structure
Assuming that Hund's rule is violated, the bond order and magnetic nature of the diatomic molecule B2 is
1 and diamagnetic
0 and diamagnetic
1 and paramagnetic
0 and paramagnetic
1 and diamagnetic
Solution
For molecules lighter than O2, the increasing order of
energies of molecular orbitals is
σ1sσ∗1sσ2sσ∗2s \bigg[\begin{array}
\ \pi2p_y \\\
\pi2p_z \\\
\end{array}\bigg] σ2pxσ∗2px \bigg[\begin{array}
\ {\pi}^{*}2p_y \\\
{\pi}^{*}2p_z \\\
\end{array} ......
where, π2py and π2pz are degenerate molecular orbitals, first singly occupied and then pairing starts if Hund's rule is obeyed. If Hund's rule is violated in B2, electronic arrangement would be
\sigma1 s^2\ _{\sigma}^{*} 1s^2 \sigma2s^2 \ _{\sigma}^{*}2s^2 \bigg[\begin{array}
\ \pi2p_y^2 \\\
\pi2p_z \\\
\end{array}.....
No unpaired electron-diamagnetic.
Bond order=2bondingelectrons−antibondingelectrons
=26−4=1