Geometry & MOs

Info

ID:	241329
PubChem CID:	96022813
Reduced:	FON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	284.132491
ΔH_f, kcal/mol:	-25.05
Dipole, Da:	4.39
IP(EA), eV:	-8.49(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(2S)-2,3-dihydro-1H-indol-2-yl]-6-fluoro-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C1CN[C@H](C2=C1C=CC(=C2F)O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations