MOs OF COMMON METAL FRAGMENTS OF ORGANOMETALLICS


All web pages were generated using WEBMO and the calculations were carried out using GAUSSIAN suite of programs.
Clicking on the molecule name goes to the page showing the MOLECULAR ORBITALS.
This page connects you to the pages with frontier molecular orbitals of typical molecules having a linear bonding environment.

To see molecules different numbers of ligands, go to the master table: COMFORT

2 COORDINATED COMPLEXES MOLECULE GEOMETRY &
VIBRATIONS		 MOLECULAR ORBITALS VIBRATIONS BOND ORDER












LINEAR Cu complex [Cu(CH3)2]- [Cu(CH3)2]- [Cu(CH3)2]-


Fragment [Cu(CH3)] [Cu(CH3)] [Cu(CH3)]

LINEAR Au complex [Au(CO)2]+ [Au(CO)2]+ [Au(CO)2]+


Fragment [Au(CO)]+ [Au(CO)]+ [Au(CO)]+








[Au(Cl)2]- [Au(Cl)2]- [Au(Cl)2]-


Fragment
[AuCl] 		[AuCl] [AuCl]







BENT COMPLEXES
 Ni(CO)2
 Ni(CO)2 Ni(CO)2


Fragment Ni(CO)
 Ni(CO) Ni(CO)