Geometry & MOs

Info

ID:	21286
PubChem CID:	587844
Reduced:	FNO2C7H8 (1)
Stoich.:	ABC2D7E8 (1)
Weight, g/mol:	157.053907
ΔH_f, kcal/mol:	-111.89
Dipole, Da:	3.36
IP(EA), eV:	-9.03(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-5-fluorobenzene-1,2-diol

Drug info:

PubChemData

Smile

C1=C(C(=CC(=C1O)O)F)CN

DOS

IR

Vibrations