Geometry & MOs

Info

ID:	68482
PubChem CID:	46508503
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	330.080491
ΔH_f, kcal/mol:	-124.5
Dipole, Da:	2.77
IP(EA), eV:	-8.9(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-2-methylanilino)-N-(3-methyl-1,1-dioxothiolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1(CCS(=O)(=O)C1)NC(=O)CNC2=CC=CC=C2OC3=CC=CC=C3

DOS

IR

Vibrations