Molecular Orbital Formation & Bond Order

Two 1s orbitals combining by linear combination (LCAO). Choose a nucleus and an electron count to explore H₂⁺, H₂, He₂⁺, He₂ and more.

H₂
electron configuration
(σ1s)²
bond order
1
4.00 Å

Bonding orbital: σ(1s), in phase ψ = 1sA + 1sB
Antibonding orbital: σ*(1s), out of phase ψ = 1sA − 1sB
positive phase negative phase nodal plane (ψ = 0)

MO energy-level diagram one-electron levels at current R
Potential energy curve electronic energy only