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Molecular orbital diagram

Written by the Fiveable Content Team โ€ข Last updated September 2025
Written by the Fiveable Content Team โ€ข Last updated September 2025

Definition

A molecular orbital diagram is a graphical representation that shows the relative energy levels of molecular orbitals formed from atomic orbitals during the bonding process in a molecule. It helps visualize the bonding, anti-bonding, and non-bonding interactions between atoms.

5 Must Know Facts For Your Next Test

  1. Molecular orbital diagrams are constructed based on the linear combination of atomic orbitals (LCAO) method.
  2. Bonding molecular orbitals are lower in energy than the original atomic orbitals, while anti-bonding molecular orbitals are higher in energy.
  3. The number of molecular orbitals formed is equal to the number of combining atomic orbitals.
  4. Electrons fill molecular orbitals according to Hund's rule and the Pauli exclusion principle.
  5. The bond order can be calculated using the formula: $(\text{number of electrons in bonding MOs} - \text{number of electrons in anti-bonding MOs})/2$.

Review Questions

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