FRONTIER MOLECULAR ORBITALS OF COMMON METAL FRAGMENTS OF ORGANOMETALLICS


This page connects you to the pages with frontier molecular orbitals of typical molecules with square pyramidal geometry.
Odd electron species are avoided. Instead, the closest cationic or anionic species are computed.
Mn(CO)5 is a radical and so the cation and the anion are presented.
All web pages were generated using WEBMO and the calculations were carried out using GAUSSIAN suite of programs.  

Return to the main page to navigate to other species.  CLICK HERE



SQUARE PYRAMIDAL
MOLECULE
MOLECULE GEOMETRY MOLECULAR ORBITALS VIBRATIONS BOND ORDER



















[Manganese pentacarbonyl]+
[Manganese pentacarbonyl]+


[Manganese (pentacarbonyl)]-

[Manganese (pentacarbonyl)]-







Fragment ML4 Fe(CO)4
Fe(CO)4








Mn(CO)4 for allyl
Mn(CO)4 for allyl







Square Planar ML4  [PtCl4]2-