Geometry & MOs

Info

ID:	23736
PubChem CID:	605727
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-50.22
Dipole, Da:	1.05
IP(EA), eV:	-8.44(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methoxy-1-methyl-3,4-dihydroisoquinolin-6-ol

Drug info:

PubChemData

Smile

CC1=NCCC2=CC(=C(C=C12)OC)O

DOS

IR

Vibrations