Geometry & MOs

Info

ID:

14206

PubChem CID:

406640

Reduced:

ClNO2S2H11C14 (2)

Stoich.:

ABC2D2E11F14 (2)

Weight, g/mol:

647.983947

ΔHf, kcal/mol:

-38.31

Dipole, Da:

9.59

IP(EA), eV:

 -8.61(-1.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-benzylidene-2-[[2-(benzylideneamino)sulfonyl-5-chloro-4-methylphenyl]disulfanyl]-4-chloro-5-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Cl)SSC2=C(C=C(C(=C2)Cl)C)S(=O)(=O)N=CC3=CC=CC=C3)S(=O)(=O)N=CC4=CC=CC=C4

DOS

IR

Vibrations