Geometry & MOs

Info

ID:	27639
PubChem CID:	822754
Reduced:	NOCl2H9C10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	219.075625
ΔH_f, kcal/mol:	-28.93
Dipole, Da:	6.88
IP(EA), eV:	-8.9(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(pyridin-3-ylmethyl)-1,2,5-oxadiazole-3-carboxamide

Drug info:

PubChemData

Smile

C/C=C/C(=O)NC1=CC(=C(C=C1)Cl)Cl

DOS

IR

Vibrations