Geometry & MOs

Info

ID:	52474
PubChem CID:	12015349
Reduced:	FeOH16C18 (1)
Stoich.:	ABC16D18 (1)
Weight, g/mol:	322.065615
ΔH_f, kcal/mol:	47.54
Dipole, Da:	3.24
IP(EA), eV:	-8.86(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopenta-1,3-diene;1-cyclopenta-2,4-dien-1-yl-2-phenylethane-1,2-diol;iron(2+)

Drug info:

PubChemData

Smile

[CH-]1C=CC=C1.C1=CC=C(C=C1)[C@@H]2[C@H](O2)[C-]3C=CC=C3.[Fe+2]

DOS

IR

Vibrations