Molecular Orbital Theory

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Molecular Orbital Theory Flash Review CHEM 371 Dr. Christopher B. Durr © 2019 by Christopher Durr, Molecular Orbital Theory Flash Review. This work is licensed under a Creative Commons Attribution-NonCommercial-ShareAlike 4.0 International License.

Atomic Orbitals 1s 1 Radial Node 2s 1 Planar Node 2p 2 Planar Nodes 3d z Atomic Orbitals x y 1s 1 Radial Node 2s 1 Planar Node 2p pz py pz 2 Planar Nodes 3d dz2 dx2-y2 dyz dxy dxz

Molecular Orbitals – O2 O2 O O x y z 2pz 2py 2px 2pz 2py 2px Energy 2s

Molecular Orbitals – O2 O2 O O x y z σ* π* π σ σ* σ 2pz 2py 2px 2pz Energy σ σ* 2s 2s σ

Molecular Orbitals – O2 O2 O O x y z σ* π* π σ σ* σ 2pz 2py 2px 2pz Energy σ σ* 2s 2s σ

Effect of Oxidation/Reduction y z σ* Bond Order O2 𝟖−𝟒 𝟐 = O O π* 2 120.8 pm O2+ 𝟖−𝟑 𝟐 = O O 2.5 π 112.3 pm Energy O2- σ 𝟖−𝟓 𝟐 = O O 1.5 σ* 128 pm O22- 𝟖−𝟔 𝟐 = O O 1 σ 149 pm