Geometry & MOs

Info

ID:	339748
PubChem CID:	127261750
Reduced:	ClSO2N3H8C13 (1)
Stoich.:	ABC2D3E8F13 (1)
Weight, g/mol:	237.049804
ΔH_f, kcal/mol:	85.35
Dipole, Da:	3.78
IP(EA), eV:	-9.18(-1.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[amino(nitro)amino]imidazo[1,2-a]pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CSC(=C1)/C=C/C2=C(N3C=C(C=CC3=N2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations