Geometry & MOs

Info

ID:

53657

PubChem CID:

14717693

Reduced:

FeO3C9H21 (1)

Stoich.:

AB3C9D21 (1)

Weight, g/mol:

323.115699

ΔHf, kcal/mol:

-153.75

Dipole, Da:

4.06

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.772222

Charge, e:

 0

Chem-info

IUPAC name:

2-ethoxyethanolate;iron(3+)

Drug info:

PubChemData

Smile

CCC[O-].CCC[O-].CCC[O-].[Fe+3]

DOS

IR

Vibrations