Geometry & MOs

Info

ID:	253970
PubChem CID:	103121905
Reduced:	FO3N4C12H13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	285.133808
ΔH_f, kcal/mol:	-88.97
Dipole, Da:	7.62
IP(EA), eV:	-9.33(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CN2C(=C(N=N2)C(=O)O)CN)F

DOS

IR

Vibrations