Geometry & MOs

Info

ID:	301880
PubChem CID:	123099069
Reduced:	ClSN2O5C19H21 (1)
Stoich.:	ABC2D5E19F21 (1)
Weight, g/mol:	438.02489
ΔH_f, kcal/mol:	-159.37
Dipole, Da:	4.63
IP(EA), eV:	-8.35(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylpropanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)S(=O)CC(=O)NC2=CC=C(C=C2)OC

DOS

IR

Vibrations