Geometry & MOs

Info

ID:	242142
PubChem CID:	96026525
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	276.107419
ΔH_f, kcal/mol:	-90.86
Dipole, Da:	2.86
IP(EA), eV:	-8.62(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-8-fluoro-1-(5-fluoropyridin-2-yl)-7-methoxy-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)O)[C@@H]2C3=CC(=C(C=C3CCN2)F)OC

DOS

IR

Vibrations