Geometry & MOs

Info

ID:	88966
PubChem CID:	49958288
Reduced:	N2O3C21H24 (1)
Stoich.:	A2B3C21D24 (1)
Weight, g/mol:	328.02113
ΔH_f, kcal/mol:	-39.99
Dipole, Da:	3.93
IP(EA), eV:	-8.81(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromo-4-methylphenyl)-5-(2-methylphenyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)COC3=CC=C(C=C3)C(C)C

DOS

IR

Vibrations