Geometry & MOs

Info

ID:	89314
PubChem CID:	49960453
Reduced:	N2O2H24C25 (1)
Stoich.:	A2B2C24D25 (1)
Weight, g/mol:	318.173213
ΔH_f, kcal/mol:	28.67
Dipole, Da:	4.96
IP(EA), eV:	-8.83(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenyl)-5-[(E)-2-(4-methylphenyl)ethenyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)COC3=CC=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations