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Chemical Bonding and Molecular Structure question

2021 · 25 Feb · Shift 1 · Q9
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Chemical Bonding and Molecular Structure question

2021 · 25 Feb · Shift 1 · Q9

JEE MainChemistryChemical Bonding and Molecular StructureMCQ+4 / −1
According to molecular orbital theory, the species among the following that does not exist is :
  1. A
    O22−{O_2}^{2 - }O2​2−
  2. B
    Be2B{e_2}Be2​
  3. C
    He2−H{e_2}^ -He2​−
  4. D
    He2+H{e_2}^ +He2​+
View written solutionFree

Correct answer: B

  1. Criterion from Molecular Orbital Theory

A diatomic species exists if its bond order is positive.

Bond order=Nb−Na2\text{Bond order} = \frac{N_b - N_a}{2}Bond order=2Nb​−Na​​

where:

  • NbN_bNb​ = number of electrons in bonding molecular orbitals
  • NaN_aNa​ = number of electrons in antibonding molecular orbitals

If bond order >0>0>0, the species can exist. If bond order =0=0=0, it does not exist.


  1. Option A: O22−{O_2}^{2-}O2​2−

O2O_2O2​ has 16 electrons, so O22−{O_2}^{2-}O2​2− has 18 electrons.

For oxygen, filling of MOs gives bond order of neutral O2O_2O2​ as 2. Adding 2 electrons fills antibonding π∗\pi^*π∗ orbitals further, reducing bond order by 1.

So,

Bond order of O22−=1\text{Bond order of } {O_2}^{2-} = 1Bond order of O2​2−=1

Since bond order is positive, O22−{O_2}^{2-}O2​2− exists.


  1. Option B: Be2Be_2Be2​

Each Be atom has 4 electrons, so Be2Be_2Be2​ has 8 electrons.

Electronic configuration in MOs:

σ(1s)2 σ∗(1s)2 σ(2s)2 σ∗(2s)2\sigma(1s)^2\, \sigma^*(1s)^2\, \sigma(2s)^2\, \sigma^*(2s)^2σ(1s)2σ∗(1s)2σ(2s)2σ∗(2s)2

Bonding electrons = 4 in relevant filled bonding orbitals (σ1s\sigma 1sσ1s, σ2s\sigma 2sσ2s) Antibonding electrons = 4 in relevant filled antibonding orbitals (σ∗1s\sigma^*1sσ∗1s, σ∗2s\sigma^*2sσ∗2s)

Thus,

Bond order=4−42=0\text{Bond order} = \frac{4-4}{2} = 0Bond order=24−4​=0

So Be2Be_2Be2​ does not exist.


  1. Option C: He2−He_2^-He2−​

Each He has 2 electrons, so He2−He_2^-He2−​ has 2+2+1=52+2+1=52+2+1=5 electrons.

MO configuration:

σ(1s)2 σ∗(1s)2 σ(2s)1\sigma(1s)^2\, \sigma^*(1s)^2\, \sigma(2s)^1σ(1s)2σ∗(1s)2σ(2s)1

(Equivalently, considering only 1s-derived MOs for helium, the extra electron gives a positive bond order overall.)

Using bond order counting:

  • bonding electrons = 3
  • antibonding electrons = 2

Bond order=3−22=12\text{Bond order} = \frac{3-2}{2} = \frac{1}{2}Bond order=23−2​=21​

So He2−He_2^-He2−​ exists.


  1. Option D: He2+He_2^+He2+​

He2+He_2^+He2+​ has 2+2−1=32+2-1=32+2−1=3 electrons.

MO configuration:

σ(1s)2 σ∗(1s)1\sigma(1s)^2\, \sigma^*(1s)^1σ(1s)2σ∗(1s)1

Thus,

  • bonding electrons = 2
  • antibonding electrons = 1

Bond order=2−12=12\text{Bond order} = \frac{2-1}{2} = \frac{1}{2}Bond order=22−1​=21​

So He2+He_2^+He2+​ exists.


  1. Conclusion

The only species with bond order zero is:

Be2\boxed{Be_2}Be2​​

So the species that does not exist is Option B.

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