Geometry & MOs

Info

ID:	241558
PubChem CID:	96023697
Reduced:	FNOSC11H14 (1)
Stoich.:	ABCDE11F14 (1)
Weight, g/mol:	221.121592
ΔH_f, kcal/mol:	-74.9
Dipole, Da:	2.96
IP(EA), eV:	-8.93(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]([C@H]1C2=CC(=C(C=C2CCN1)F)O)S

DOS

IR

Vibrations