Geometry & MOs

Info

ID:	241538
PubChem CID:	96023587
Reduced:	FNOC17H24 (1)
Stoich.:	ABCD17E24 (1)
Weight, g/mol:	207.105942
ΔH_f, kcal/mol:	-97.89
Dipole, Da:	3.83
IP(EA), eV:	-8.83(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-8-fluoro-1-prop-1-en-2-yl-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CCC(CC1)CC[C@@H]2C3=CC(=C(C=C3CCN2)F)O

DOS

IR

Vibrations