Geometry & MOs

Info

ID:	253967
PubChem CID:	103121895
Reduced:	O3N4C10H16 (1)
Stoich.:	A3B4C10D16 (1)
Weight, g/mol:	258.122909
ΔH_f, kcal/mol:	-86.78
Dipole, Da:	7.39
IP(EA), eV:	-10.09(-0.48)
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-2-amine

Drug info:

PubChemData

Smile

C1CCOC(C1)CN2C(=C(N=N2)C(=O)O)CN

DOS

IR

Vibrations