Geometry & MOs

Info

ID:	138815
PubChem CID:	52429780
Reduced:	ClNS2O4H16C17 (1)
Stoich.:	ABC2D4E16F17 (1)
Weight, g/mol:	466.132921
ΔH_f, kcal/mol:	-59.98
Dipole, Da:	5.5
IP(EA), eV:	-9.2(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-chloro-3-(diethylsulfamoyl)phenyl]-4-[[(2S)-oxolan-2-yl]methoxy]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)[N+](=O)[O-])SCCOC(=O)CSC2=CC=C(C=C2)Cl

DOS

IR

Vibrations