Geometry & MOs

Info

ID:	241394
PubChem CID:	96023338
Reduced:	FN2O2C15H15 (1)
Stoich.:	AB2C2D15E15 (1)
Weight, g/mol:	285.152892
ΔH_f, kcal/mol:	-74.41
Dipole, Da:	3.16
IP(EA), eV:	-8.98(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(2,3-dimethylphenyl)methyl]-8-fluoro-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

COC1=NC=CC(=C1)[C@@H]2C3=CC(=C(C=C3CCN2)F)O

DOS

IR

Vibrations