Geometry & MOs

Info

ID:	241157
PubChem CID:	96021566
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	232.157563
ΔH_f, kcal/mol:	-36.92
Dipole, Da:	1.92
IP(EA), eV:	-8.61(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-[(1R)-6-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)[C@H](NCC2)CC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations