Geometry & MOs

Info

ID:	241541
PubChem CID:	96023599
Reduced:	FNOC14H16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	233.121592
ΔH_f, kcal/mol:	-46.95
Dipole, Da:	2.86
IP(EA), eV:	-8.85(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-6-fluoro-1-[(1E,3E)-penta-1,3-dienyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

C/C=C/C=C/[C@H]1C2=C(CCN1)C=CC(=C2F)O

DOS

IR

Vibrations