Geometry & MOs

Info

ID:	386774
PubChem CID:	134982895
Reduced:	FeO3C16H16 (1)
Stoich.:	AB3C16D16 (1)
Weight, g/mol:	168.151415
ΔH_f, kcal/mol:	126.66
Dipole, Da:	2.78
IP(EA), eV:	-7.77(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC/C=C\C(=C\C1=CC=CC=C1)\C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

DOS

IR

Vibrations