Geometry & MOs

Info

ID:	241993
PubChem CID:	96024978
Reduced:	NO2C19H21 (1)
Stoich.:	AB2C19D21 (1)
Weight, g/mol:	294.173213
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	3.33
IP(EA), eV:	-8.51(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(1S)-7,8-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-yl]phenyl]acetamide

Drug info:

PubChemData

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CC1=CC2=C(C=C1C)[C@@H](NCC2)[C@@H]3COC4=CC=CC=C4O3

DOS

IR

Vibrations