Geometry & MOs

Info

ID:	253976
PubChem CID:	103121951
Reduced:	N4O4C9H16 (1)
Stoich.:	A4B4C9D16 (1)
Weight, g/mol:	325.96646
ΔH_f, kcal/mol:	-112.34
Dipole, Da:	5.88
IP(EA), eV:	-10.14(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-5-(1-methylindazol-3-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

COCCOCCN1C(=C(N=N1)C(=O)O)CN

DOS

IR

Vibrations