Geometry & MOs

Info

ID:	241599
PubChem CID:	96023803
Reduced:	NOF2C17H17 (1)
Stoich.:	ABC2D17E17 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-99.26
Dipole, Da:	3.73
IP(EA), eV:	-8.88(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-8-fluoro-1-(5-methoxy-2-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CN[C@H](C2=CC(=C(C=C21)F)O)CCC3=CC=CC=C3F

DOS

IR

Vibrations