Geometry & MOs

Info

ID:	386375
PubChem CID:	134981558
Reduced:	FeO4C10H10 (1)
Stoich.:	AB4C10D10 (1)
Weight, g/mol:	408.071048
ΔH_f, kcal/mol:	-20.91
Dipole, Da:	3.46
IP(EA), eV:	-7.52(0.0)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations