Geometry & MOs

Info

ID:	241328
PubChem CID:	96022769
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	282.116841
ΔH_f, kcal/mol:	-89.78
Dipole, Da:	2.17
IP(EA), eV:	-8.63(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-8-fluoro-1-(1H-indol-2-yl)-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)[C@H]2C3=C(CCN2)C=CC(=C3F)O)OC

DOS

IR

Vibrations