Molecular orbitals

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21 Terms

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s orbital

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Py orbital

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Px orbital

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Pz orbital

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d xy orbital

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d xz orbital

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d yz orbital

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d x2-y2 orbital

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d z2 orbital

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Bonding orbitals: energy

Bonding
- lower in energy than the atomic orbitals from which they were formed
-due to increase in shielding by nucleus

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Antibonding orbitals: energy

Antibonding
-higher in energy than the atomic orbitals from which they were formed
-due to decrease in nuclear shielding

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Constructive and destructive interference in bonding and antibonding

-Bonding: constructive interference of AO'S so they come together.
-antibonding: destructive interference of AO'S so they repulse each other

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Pi bonding

electron density is above/below the bonding axis

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sigma bonding

electron density is along the bonding axis

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Bond order

1/2 (# electrons in bonding - # electrons in antibonding)

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Born-Oppenheimer Approximation

--The motion of the nuclei and the electrons can be separated and the nuclear, electronic, and spin parts of the wavefunction can can be solved with independent wavefunctions

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gerade

-German for even, these configurations are symmetrical relative to i (inversion)

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ungerade

-German for uneven, these configurations are asymmetric relative to inversion

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symmetry-adapted linear combination of atomic orbitals (SALCs)

--determined from overlapping orbitals with same symmetry
-Gives you the wave functions for MOs
-gives a qualitative picture of the MOs in a molecule and provides a good way of predicting bonds

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sigma bonding molecular orbital

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formation of a pi bonding molecular orbital

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