Geometry & MOs

Info

ID:	253973
PubChem CID:	103121940
Reduced:	SO2N5C9H11 (1)
Stoich.:	AB2C5D9E11 (1)
Weight, g/mol:	264.95992
ΔH_f, kcal/mol:	-0.77
Dipole, Da:	6.92
IP(EA), eV:	-10.01(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-pyrazolo[1,5-a]pyrazin-3-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=NC=C(S1)CN2C(=C(N=N2)C(=O)O)CN

DOS

IR

Vibrations