Geometry & MOs

Info

ID:

11398

PubChem CID:

115022

Reduced:

FeC3N3 (1)

Stoich.:

AB3C3 (1)

Weight, g/mol:

133.944158

ΔHf, kcal/mol:

147.07

Dipole, Da:

1.96

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.827030

Charge, e:

 0

Chem-info

IUPAC name:

iron(3+);tricyanide

Drug info:

PubChemData

Smile

[C-]#N.[C-]#N.[C-]#N.[Fe+3]

DOS

IR

Vibrations