Geometry & MOs

Info

ID:	253628
PubChem CID:	103119643
Reduced:	Cl2O2N4H8C13 (1)
Stoich.:	A2B2C4D8E13 (1)
Weight, g/mol:	249.041738
ΔH_f, kcal/mol:	53.34
Dipole, Da:	5.85
IP(EA), eV:	-7.64(-2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloroethyl)-5-pyrazolo[1,5-a]pyrazin-3-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CN2C(=CN1)C(=CN2)C(=O)N=C3C=C(C(=O)C(=C3)Cl)Cl

DOS

IR

Vibrations