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Topic: MO Theory for an Octahedral Complex  (Read 1923 times)

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Offline Kate

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MO Theory for an Octahedral Complex
« on: December 16, 2013, 10:48:57 AM »
Hello.

The eg set of MO's of an octahedral complex is composed of dz2 and dx2-y2 orbitals from the metal and which orbitals from the ligand? p orbitals along the 3 axes?

Similarly, what about the t1g and a1g set of the octahedral complex?

Final question: does anyone know about books or articles explaining group theory applied to MO theory? 'Cos I don't understand any of this at all and I'd like to.

Offline Corribus

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Re: MO Theory for an Octahedral Complex
« Reply #1 on: December 16, 2013, 11:09:08 AM »
Depends on what the ligands are.  Could be p-orbitals, could be s-orbitals, could be d-orbitals, could be hybridized orbitals, could be other molecular orbitals. As long as they have the appropriate symmetry and phase, interactions are allowed.

Any decent physical chemistry book will have a chapter on symmetry treatments of molecular orbitals, including group theory. I recommend Atkins/De Paula or McQuarrie/Simon.
What men are poets who can speak of Jupiter if he were like a man, but if he is an immense spinning sphere of methane and ammonia must be silent?  - Richard P. Feynman

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