Geometry & MOs

Info

ID:	241371
PubChem CID:	96023303
Reduced:	FN2O2H15C17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	275.11217
ΔH_f, kcal/mol:	-31.51
Dipole, Da:	5.24
IP(EA), eV:	-8.97(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-6-fluoro-1-(2-fluoro-4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CN[C@H](C2=CC(=C(C=C21)F)O)CC3=NOC4=CC=CC=C43

DOS

IR

Vibrations