Geometry & MOs

Info

ID:	434910
PubChem CID:	135175970
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	202.146999
ΔH_f, kcal/mol:	-43.64
Dipole, Da:	5.58
IP(EA), eV:	-9.32(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-propan-2-yl-7,8-dihydroisoquinolin-3-amine

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CCCN3C(=O)[C@H](C)N

DOS

IR

Vibrations