Geometry & MOs

Info

ID:	253952
PubChem CID:	103121794
Reduced:	ON2C5H8 (2)
Stoich.:	AB2C5D8 (2)
Weight, g/mol:	258.122909
ΔH_f, kcal/mol:	-50.28
Dipole, Da:	6.1
IP(EA), eV:	-10.33(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-pyrazolo[1,5-a]pyrazin-3-yl-1,2,4-oxadiazol-3-yl)butan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)N2C(=C(N=N2)C(=O)O)CN

DOS

IR

Vibrations