Geometry & MOs

Info

ID:	386431
PubChem CID:	134981721
Reduced:	FeO5C8H8 (1)
Stoich.:	AB5C8D8 (1)
Weight, g/mol:	229.055385
ΔH_f, kcal/mol:	-90.6
Dipole, Da:	4.32
IP(EA), eV:	-7.39(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations