Geometry & MOs

Info

ID:	388700
PubChem CID:	134989923
Reduced:	O2N3H7C10 (1)
Stoich.:	A2B3C7D10 (1)
Weight, g/mol:	268.024229
ΔH_f, kcal/mol:	11.51
Dipole, Da:	2.83
IP(EA), eV:	-9.67(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(5-aminooxadiazol-3-ium-3-yl)ethyl]oxadiazol-3-ium-5-amine;dichloride

Drug info:

PubChemData

Smile

CC1=C2C(=O)OC3=CC=CC=C3N2N=N1

DOS

IR

Vibrations