Geometry & MOs

Info

ID:	61620
PubChem CID:	26711063
Reduced:	SCl2N3O3H17C20 (1)
Stoich.:	AB2C3D3E17F20 (1)
Weight, g/mol:	431.224263
ΔH_f, kcal/mol:	-31.9
Dipole, Da:	2.94
IP(EA), eV:	-9.57(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(diethylamino)phenyl]methyl]-3-(diethylsulfamoyl)-N-methylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations