Geometry & MOs

Info

ID:	386638
PubChem CID:	134982416
Reduced:	FeO5C13H14 (1)
Stoich.:	AB5C13D14 (1)
Weight, g/mol:	592.110197
ΔH_f, kcal/mol:	16.34
Dipole, Da:	1.45
IP(EA), eV:	-8.39(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC(=O)[C@@H](CC=C)/C=C/C=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

DOS

IR

Vibrations