Geometry & MOs

Info

ID:	131791
PubChem CID:	51261536
Reduced:	NO5C23H25 (1)
Stoich.:	AB5C23D25 (1)
Weight, g/mol:	361.168936
ΔH_f, kcal/mol:	-155.54
Dipole, Da:	8.05
IP(EA), eV:	-8.39(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-fluorophenoxy)propyl]-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-4-ol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)OC(=O)C=C2CN3CC(C4=C(C=CC(=C4C3)OC)OC)O

DOS

IR

Vibrations