Geometry & MOs

Info

ID:	70610
PubChem CID:	48413591
Reduced:	SN3O3C21H31 (1)
Stoich.:	AB3C3D21E31 (1)
Weight, g/mol:	379.202655
ΔH_f, kcal/mol:	-79.19
Dipole, Da:	3.68
IP(EA), eV:	-8.47(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-N-[5-(diethylamino)pentan-2-yl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=CC(=C(C=C1)OCC2=CSC=N2)OC

DOS

IR

Vibrations