Geometry & MOs

Info

ID:	242131
PubChem CID:	96026421
Reduced:	FNO2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	211.100857
ΔH_f, kcal/mol:	-108.52
Dipole, Da:	4.32
IP(EA), eV:	-8.73(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-6-fluoro-7-methoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol

Drug info:

PubChemData

Smile

COC1=C(C=C2CCN[C@@H](C2=C1)CO)F

DOS

IR

Vibrations