Geometry & MOs

Info

ID:	241580
PubChem CID:	96023753
Reduced:	NOF4H11C15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	287.132157
ΔH_f, kcal/mol:	-177.35
Dipole, Da:	3.92
IP(EA), eV:	-8.96(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-8-fluoro-1-(4-methoxy-2-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CN[C@H](C2=CC(=C(C=C21)F)O)C3=C(C=CC(=C3F)F)F

DOS

IR

Vibrations