Geometry & MOs

Info

ID:	9216
PubChem CID:	87201
Reduced:	NO3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	223.120843
ΔH_f, kcal/mol:	-106.59
Dipole, Da:	4.06
IP(EA), eV:	-8.62(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-8-ol

Drug info:

PubChemData

Smile

C[C@H]1C2=C(C(=C(C=C2CCN1)OC)OC)O

DOS

IR

Vibrations