Geometry & MOs

Info

ID:	129318
PubChem CID:	51072246
Reduced:	ClON3H8C9 (1)
Stoich.:	ABC3D8E9 (1)
Weight, g/mol:	127.074562
ΔH_f, kcal/mol:	33.27
Dipole, Da:	6.03
IP(EA), eV:	-9.8(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-propan-2-yl-1,2,4-oxadiazol-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C(=O)N=C(N2)Cl

DOS

IR

Vibrations