Geometry & MOs

Info

ID:	79372
PubChem CID:	49748296
Reduced:	Cl2N3O3H17C21 (1)
Stoich.:	A2B3C3D17E21 (1)
Weight, g/mol:	399.125277
ΔH_f, kcal/mol:	-57.93
Dipole, Da:	7.91
IP(EA), eV:	-8.69(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl)N(C1)C(=O)C4=CC=CO4

DOS

IR

Vibrations