Geometry & MOs

Info

ID:	23792
PubChem CID:	606102
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-111.23
Dipole, Da:	4.75
IP(EA), eV:	-8.18(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)ethyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

COC1=C(C=C2C(NCCC2=C1)CCN3CCCC3=O)OC

DOS

IR

Vibrations