Molecular Orbital Theory
multiple bonds - overlap of p orbitals
- sigma bonds - single bonds where electron density concentrated symmetrically around line connecting the nuclei
- pi bonds - overlapping electron regions lie above/below internuclear axis
- can’t experimentally be seen
- single bond - 1 sigma bond
- double bond - 1 sigma bond, 1 pi bond
- triple bond - 1 sigma bond, 2 pi bonds
- delocalized pi bonding - cannot be described as individual electron bond between atoms
- split up all around the molecule
- explains identical length of alternating single/double bonds in molecules like benzene
- found in all molecules w/ 2+ resonance structures
molecular orbital theory - describes electrons in terms of molecular orbitalsÂ
- bonding molecular orbital - lower energy molecular orbital
- electron attracted to both nuclei
- very stable
- antibonding molecular orbital - little electron density between nuclei
- higher energy molecular orbital
- atomic orbitals cancel each other out, area of largest electron density found on opposite sides of nuclei
- energy-level diagram - aka molecular orbital diagram
- shows interactions of atomic orbitals
- bond order = 1/2(# of bonding electrons - # of nonbonding electrons)
- 0 >> no bond
- 1 >> single bond
- 2 >> double bond
- 3 >> triple bond
- # of molecular orbitals = # of atomic orbitals combined
- atomic orbitals combine best w/ same type of atomic orbitals
- overlap increase >> bonding lower in energy, antibonding higher in energy
- each molecular orbital can hold at most 2 electrons (w/ alternate spins)
- antibonding/bonding pi molecular orbitals lower in energy than antibonding sigma orbitals, higher in energy than bonding sigma orbitals (unless interactions between s and p levels exist)
molecular properties of electron configurations
- paramagnetism - molecules w/ unpaired electrons attracted into magnetic fields
- diamagnetism - molecules w/ no unpaired electrons weakly repelled by magnetic fields
- bond order increase >> bond distance decrease, bond enthalpy increase
- heteronuclear diatomic molecule - diatomic molecule made up of different atoms
- homonuclear diatomic molecule - diatomic molecules made up of same atoms
- will resemble homonuclear molecular orbital diagram if electronegativities are not too far off
- may have non-integer bond order value
Subject:
Chemistry [1]
Subject X2:
Chemistry [1]