Geometry & MOs

Info

ID:	18696
PubChem CID:	546450
Reduced:	ClON2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	236.071641
ΔH_f, kcal/mol:	5.01
Dipole, Da:	3.6
IP(EA), eV:	-9.6(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chlorophenyl)-5-(2-methylpropyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)CC1=NN=C(O1)C2=CC=CC=C2Cl

DOS

IR

Vibrations