Geometry & MOs

Info

ID:	341549
PubChem CID:	127264242
Reduced:	ClFN3C7H7 (1)
Stoich.:	ABC3D7E7 (1)
Weight, g/mol:	184.051574
ΔH_f, kcal/mol:	-26.65
Dipole, Da:	3.14
IP(EA), eV:	-8.5(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-pyrrolo[2,3-b]pyridine-3,5-diamine;hydrochloride

Drug info:

PubChemData

Smile

C1=C(C=NC2=C1C(=CN2)N)F.Cl

DOS

IR

Vibrations