Geometry & MOs

Info

ID:

17042

PubChem CID:

482747

Reduced:

N2S2Cl4O6H11C22 (2)

Stoich.:

A2B2C4D6E11F22 (2)

Weight, g/mol:

1209.756628

ΔHf, kcal/mol:

-223.53

Dipole, Da:

10.8

IP(EA), eV:

 -8.67(-2.19)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,4-dichloro-3-[10,15,20-tris(2,6-dichloro-3-sulfophenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C1N2)C6=C(C=CC(=C6Cl)S(=O)(=O)O)Cl)C7=C(C=CC(=C7Cl)S(=O)(=O)O)Cl)C8=C(C=CC(=C8Cl)S(=O)(=O)O)Cl)C9=C(C=CC(=C9Cl)S(=O)(=O)O)Cl

DOS

IR

Vibrations