Geometry & MOs

Info

ID:	301881
PubChem CID:	123099070
Reduced:	BrSN2O4C18H19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	394.075406
ΔH_f, kcal/mol:	-112.71
Dipole, Da:	4.03
IP(EA), eV:	-8.44(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations