Geometry & MOs

Info

ID:	65171
PubChem CID:	29204563
Reduced:	ClN3O3H16C18 (1)
Stoich.:	AB3C3D16E18 (1)
Weight, g/mol:	478.144154
ΔH_f, kcal/mol:	-55.14
Dipole, Da:	2.89
IP(EA), eV:	-9.17(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-chlorobenzoyl)amino]carbamoyl]-N,N-diethyl-4-pyrrolidin-1-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)N/C(=C/C1=CC=CC=C1)/C(=O)NNC(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations