Gaussian with Avogadro: Meet Metals Complexes

GAUSSIAN TUTORIAL ON d-ORBTIALS:
1) 2 complexes with Ni
2) 2 complexes with Cr
3) How to avoid some errors
4) How to spot problems

[@arnauldroberttapa2139]

Hi. Thanks. Please are you using your Gaussian Software on Windows? If so can you please tell me how you did to install it?

[@amalkhaled3814]

while drawing the bond between the transition metal and the ligand,,which type of bonds do you choose?

[@prasantabandyopadhyay2210]

A lot of thanks....

[@ChemDamned]

I randomly clicked on the timeline and watched the chromium hexacarbonyl example. The electron count is wrong and so is the orbital diagram, you're mainly confusing charge with donated electrons. In fact, chromium puts all his electrons in the t2g orbitals whereas CO contributes with 12 electrons that fill lower energy MOs. So, let's say we want to focus only on the t2g and eg* orbitals. On one side you'll have completely empty eg* orbitals and on the other side completely filled t2g orbitals.

[@satinkorea]

How to calculate the molecular orbitals of Organo-metalic complexes, where a M2+ complexes with a schiff base

[@hamzaallal1867]

thanks

[@dubito0ergo0cogito]

I don't understand why in the example [NiCl4]2- we have 8 electrons in d orbitals? should not be 10? in Ni2+ we have 6 electrons in d orbitals so if we add 4 electrons from 4*Cl- then will be 10 electrons, not 8

[@IaNiusha]

You can read this: www.adichemistry.com/jee/qb/coordination-chemistry/1/q1.html I hope it'll help you out.

[@dubito0ergo0cogito]

ok, you're right, in [NiCl4]2- we have 8 electrons on d orbitals because sp3 hybridization, but in [Ni(CN)4]2- we have exactly 10 electrons on d orbitals, because dsp2 hybridization. On your film you are saying that these two cases have the same 8 electrons on d orbitals, these is not true

[@IaNiusha]

well i guess i made a mistake then =)

[@alejouchihasama]

which means the letter N next to the numeral # ??

[@IaNiusha]

#N: Normal print level; this is the default. #P: Additional output is generated. #T: Terse output: output is reduced to essential information and results.

[@alejouchihasama]

gracias

[@李明哲-n2q]

Girl ! ! !