Geometry & MOs

Info

ID:	242112
PubChem CID:	96026332
Reduced:	FON3C15H16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	292.077869
ΔH_f, kcal/mol:	-23.52
Dipole, Da:	1.77
IP(EA), eV:	-8.81(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(6-chloropyridin-2-yl)-8-fluoro-7-methoxy-1,2,3,4-tetrahydroisoquinoline

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)[C@H]2C3=C(CCN2)C=CC(=C3F)OC

DOS

IR

Vibrations