Geometry & MOs

Info

ID:	23810
PubChem CID:	606145
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-80.06
Dipole, Da:	3.25
IP(EA), eV:	-8.38(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

COC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)F)OC

DOS

IR

Vibrations