Geometry & MOs

Info

ID:	241442
PubChem CID:	96023415
Reduced:	FNOC12H14 (1)
Stoich.:	ABCD12E14 (1)
Weight, g/mol:	221.121592
ΔH_f, kcal/mol:	-49.36
Dipole, Da:	3.31
IP(EA), eV:	-8.89(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-but-3-enyl-8-fluoro-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CC1[C@@H]2C3=CC(=C(C=C3CCN2)F)O

DOS

IR

Vibrations