Geometry & MOs

Info

ID:	199760
PubChem CID:	79292229
Reduced:	Cl3N3H10C14 (1)
Stoich.:	A3B3C10D14 (1)
Weight, g/mol:	295.062677
ΔH_f, kcal/mol:	51.38
Dipole, Da:	4.14
IP(EA), eV:	-9.57(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-methoxy-3-oxopropyl)imidazo[4,5-c]pyridin-2-yl]sulfanylacetic acid

Drug info:

PubChemData

Smile

C1=CN=CC2=C1N(C(=N2)CCCl)C3=CC(=CC(=C3)Cl)Cl

DOS

IR

Vibrations