Geometry & MOs

Info

ID:	64605
PubChem CID:	29203207
Reduced:	N3O3C19H19 (1)
Stoich.:	A3B3C19D19 (1)
Weight, g/mol:	458.198777
ΔH_f, kcal/mol:	-79.87
Dipole, Da:	1.58
IP(EA), eV:	-8.57(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamidophenyl)-5-(diethylsulfamoyl)-2-pyrrolidin-1-ylbenzamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=CC=C1)NC(=O)/C(=C\C2=CC=CC=C2)/NC(=O)C

DOS

IR

Vibrations