Geometry & MOs

Info

ID:	253756
PubChem CID:	103120421
Reduced:	N5O5C13H21 (1)
Stoich.:	A5B5C13D21 (1)
Weight, g/mol:	278.091609
ΔH_f, kcal/mol:	-194.51
Dipole, Da:	7.82
IP(EA), eV:	-10.23(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)NC)N1C(=C(N=N1)C(=O)O)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations