Geometry & MOs

Info

ID:	31669
PubChem CID:	856001
Reduced:	BrON2H11C16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	343.079076
ΔH_f, kcal/mol:	39.49
Dipole, Da:	3.94
IP(EA), eV:	-8.92(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=CC=N2)C(=C1)NC(=O)C3=CC=C(C=C3)Br

DOS

IR

Vibrations