Geometry & MOs

Info

ID:	279461
PubChem CID:	103844009
Reduced:	ON5C9H15 (1)
Stoich.:	AB5C9D15 (1)
Weight, g/mol:	324.9366
ΔH_f, kcal/mol:	12.92
Dipole, Da:	3.56
IP(EA), eV:	-9.46(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-bromo-4-chlorophenyl)-3-(1H-1,2,4-triazol-5-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C1=NC=NN1)NC(=O)CNC2CC2

DOS

IR

Vibrations