Geometry & MOs

Info

ID:	201326
PubChem CID:	79525398
Reduced:	ClOSN4H11C14 (1)
Stoich.:	ABCD4E11F14 (1)
Weight, g/mol:	360.976476
ΔH_f, kcal/mol:	76.4
Dipole, Da:	3.85
IP(EA), eV:	-8.74(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[2-(4-chlorophenyl)sulfonylethylsulfanyl]aniline

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)C2=NOC(=N2)CSC3=C(C=CC(=C3)Cl)N

DOS

IR

Vibrations