Geometry & MOs

Info

ID:	1954
PubChem CID:	5418
Reduced:	NO4C20H25 (1)
Stoich.:	AB4C20D25 (1)
Weight, g/mol:	343.178358
ΔH_f, kcal/mol:	-112.45
Dipole, Da:	3.85
IP(EA), eV:	-8.11(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC)OC

DOS

IR

Vibrations