Geometry & MOs

Info

ID:	368431
PubChem CID:	127328590
Reduced:	SO2N6C14H20 (1)
Stoich.:	AB2C6D14E20 (1)
Weight, g/mol:	343.192963
ΔH_f, kcal/mol:	18.02
Dipole, Da:	10.22
IP(EA), eV:	-9.36(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-oxoethyl]pyrrolidin-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1CCN(C1)CCC2=NN=NN2C3=CC=CC=C3

DOS

IR

Vibrations