JEE Challenger
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Paramagnetic Diatomic Species Without Two S Two P Mixing

Assuming that 2s-2p2s\text{-}2p mixing is not operative, identify the paramagnetic species among the following:

Options

A

Be2\mathrm{Be}_2

B

B2\mathrm{B}_2

C

C2\mathrm{C}_2

Correct
D

N2\mathrm{N}_2

Step-by-Step Solution

According to Molecular Orbital Theory (MOT), when 2s-2p2s\text{-}2p mixing is not operative (similar to the standard orbital ordering observed in O2\mathrm{O}_2 and F2\mathrm{F}_2), the increasing order of energies of the molecular orbitals is:

σ1s<σ1s∗<σ2s<σ2s∗<σ2pz<(π2px=π2py)<(π2px∗=π2py∗)<σ2pz∗\sigma_{1s} < \sigma^*_{1s} < \sigma_{2s} < \sigma^*_{2s} < \sigma_{2p_z} < (\pi_{2p_x} = \pi_{2p_y}) < (\pi^*_{2p_x} = \pi^*_{2p_y}) < \sigma^*_{2p_z}

Now, let us determine the electronic configurations of the given homonuclear diatomic species assuming no 2s-2p2s\text{-}2p mixing:

  1. Be2\mathrm{Be}_2 (Total electrons =8= 8): \sigma_{1s}^2\ \sigma^*_{1s}^2\ \sigma_{2s}^2\ \sigma^*_{2s}^2

    • Number of unpaired electrons, n=0n = 0.
    • Hence, Be2\mathrm{Be}_2 is diamagnetic.
  2. B2\mathrm{B}_2 (Total electrons =10= 10): \sigma_{1s}^2\ \sigma^*_{1s}^2\ \sigma_{2s}^2\ \sigma^*_{2s}^2\ \sigma_{2p_z}^2

    • Number of unpaired electrons, n=0n = 0.
    • Hence, B2\mathrm{B}_2 is diamagnetic.
  3. C2\mathrm{C}_2 (Total electrons =12= 12): \sigma_{1s}^2\ \sigma^*_{1s}^2\ \sigma_{2s}^2\ \sigma^*_{2s}^2\ \sigma_{2p_z}^2\ \pi_{2p_x}^1\ \pi_{2p_y}^1

    • According to Hund's rule of maximum multiplicity, the degenerate π2px\pi_{2p_x} and π2py\pi_{2p_y} orbitals each receive one unpaired electron.
    • Number of unpaired electrons, n=2n = 2.
    • Hence, C2\mathrm{C}_2 is paramagnetic.
  4. N2\mathrm{N}_2 (Total electrons =14= 14): \sigma_{1s}^2\ \sigma^*_{1s}^2\ \sigma_{2s}^2\ \sigma^*_{2s}^2\ \sigma_{2p_z}^2\ \pi_{2p_x}^2\ \pi_{2p_y}^2

    • Number of unpaired electrons, n=0n = 0.
    • Hence, N2\mathrm{N}_2 is diamagnetic.

Therefore, the paramagnetic species under the assumption of no 2s-2p2s\text{-}2p mixing is C2\mathrm{C}_2.

Correct Option: (C)