Geometry & MOs

Info

ID:	14973
PubChem CID:	425648
Reduced:	FeCl2N2C14H21 (2)
Stoich.:	AB2C2D14E21 (2)
Weight, g/mol:	688.083279
ΔH_f, kcal/mol:	68.32
Dipole, Da:	5.04
IP(EA), eV:	-6.94(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

iron(2+);tetrachloroiron;2,10,18,26-tetrazanidapentacyclo[26.4.0.04,9.012,17.020,25]dotriaconta-1(32),27,30-triene

Drug info:

PubChemData

Smile

C1CCC2C(C1)C[N-]C3CCCCC3C[N-]C4=CC=CCC4=C[N-]C5CCCCC5C[N-]2.Cl[Fe](Cl)(Cl)Cl.[Fe+2]

DOS

IR

Vibrations