Geometry & MOs

Info

ID:

409120

PubChem CID:

135081896

Reduced:

FeC11H11 (1)

Stoich.:

AB11C11 (1)

Weight, g/mol:

273.094176

ΔHf, kcal/mol:

143.82

Dipole, Da:

1.35

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.379844

Charge, e:

 0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=CC=C1.C1=C[CH]C=C1.[Fe]

DOS

IR

Vibrations