| | ____ 1sσ* | |
| ____ 1s | E  | 1s _____ |
| H | H |
| | _____1sσ | |
| | H2 | |
The
energy of
one of the
molecular orbitals formed on overlap of atomic orbitals is
higher than that of the atomic orbitals, and the energy of the
other molecular orbital is
lower.
The molecular orbital with higher electron density between the nuclei is of lower energy because these electrons are attracted to both nuclei.
The
lower energy molecular orbital (1
sσ in this case) is more stable than the atomic orbitals on separated atoms and is referred to as a
bonding orbital.
Electrons in bonding molecular orbitals stabilize the molecule.
The
higher energy orbital (1
sσ* in this case) is referred to as an
antibonding orbital.
Electrons in antibonding molecular orbitals destabilize the molecule.
Each pair of atomic orbitals overlap to give a bonding and an antibonding molecular orbital. The electron density in regions between the nuclei is higher in bonding than in antibonding orbitals.
The
number of electrons occupying valence molecular orbitals for a particular species
equals the number of valence electrons for that species.
In the
most stable electron configuration the electrons are in orbitals of
lowest energy.
No more than two electrons can occupy a molecular orbital. The two electrons must have opposite spin.
Molecular orbitals of equal energy are all occupied singly before a second electron enters any of them.