Geometry & MOs

Info

ID:	241548
PubChem CID:	96023615
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-89.08
Dipole, Da:	4.1
IP(EA), eV:	-8.63(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-6-fluoro-1-[(4-methylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations