Geometry & MOs

Info

ID:	15793
PubChem CID:	450807
Reduced:	FNO3C8H10 (1)
Stoich.:	ABC3D8E10 (1)
Weight, g/mol:	186.067006
ΔH_f, kcal/mol:	-156.45
Dipole, Da:	3.99
IP(EA), eV:	-8.92(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1R)-2-amino-1-hydroxyethyl]-5-(18F)fluoranylbenzene-1,2-diol

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1O)O)[18F])[C@H](CN)O

DOS

IR

Vibrations