Geometry & MOs

Info

ID:	301882
PubChem CID:	123099071
Reduced:	ClSN2O4C18H19 (1)
Stoich.:	ABC2D4E18F19 (1)
Weight, g/mol:	313.098394
ΔH_f, kcal/mol:	-122.58
Dipole, Da:	2.35
IP(EA), eV:	-8.3(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylacetate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC=C1Cl)S(=O)CC(=O)NC2=CC=C(C=C2)OC

DOS

IR

Vibrations