Geometry & MOs

Info

ID:	14320
PubChem CID:	409126
Reduced:	ClNH7C11 (4)
Stoich.:	ABC7D11 (4)
Weight, g/mol:	754.103858
ΔH_f, kcal/mol:	213.87
Dipole, Da:	2.39
IP(EA), eV:	-8.22(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,10,15,20-tetrakis(4-chlorophenyl)-21,22,23,24-tetrahydroporphyrin

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=C(C6=CC=C2N6)C7=CC=C(C=C7)Cl)N5)C8=CC=C(C=C8)Cl)C9=CC=C(C=C9)Cl)N3)Cl

DOS

IR

Vibrations