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Topic: transmition metals  (Read 2475 times)

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Offline luketapis

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transmition metals
« on: April 15, 2012, 06:43:43 PM »
Hi
I have a question about dnconfiguration for this molecule:
[Ir(CO)Cl(PPh3)2]
ligands charges are:
CO: n
Cl : -1
PPh3: n

so Ir(I)
Ir configuration is: 3d7 4s2

If we take one electron away from Ir, we letf with d7 or d8 ?

Offline Schrödinger

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Re: transmition metals
« Reply #1 on: April 16, 2012, 05:17:40 AM »
Ir configuration is: 3d7 4s2
[Xe] 4f14 5d7 6s2
And I guess you should be left with d7 s1
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Offline Dan

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Re: transmition metals
« Reply #2 on: April 16, 2012, 06:19:56 AM »
The ground state of Ir+ is s1d7

luketapis: Note that atomic orbitals do not provide a good representation of the electronic structure of transition metal complexes, you should use molecular orbitals (ligand field theory).
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Offline cheese (MSW)

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Re: transmition metals
« Reply #3 on: April 16, 2012, 10:30:59 AM »
In the gas phase phase Ir^+ may be [Xe] 5d^7 6s^1, but just as likely it could be [Xe] 5d^8.
In cmplxs however TM are always referred to by their d e⁻  cnfig so trans-IrCl(CO)(PPh3)2
(Ir(I)) is a d^8 cmpd and as such is sq planar.  It is known as Vaska's cmpd.

Offline luketapis

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Re: transmition metals
« Reply #4 on: April 16, 2012, 09:02:14 PM »
that what I thought Cheese
I would go for d8 as well.
Thx :)

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