Geometry & MOs

Info

ID:	24369
PubChem CID:	609733
Reduced:	NCl2O2C18H19 (1)
Stoich.:	AB2C2D18E19 (1)
Weight, g/mol:	351.079284
ΔH_f, kcal/mol:	-48.9
Dipole, Da:	4.48
IP(EA), eV:	-8.25(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dichlorophenyl)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline

Drug info:

PubChemData

Smile

CN1CCC2=CC(=C(C=C2C1C3=C(C=C(C=C3)Cl)Cl)OC)OC

DOS

IR

Vibrations