Geometry & MOs

Info

ID:	89035
PubChem CID:	49958836
Reduced:	NOH8C9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	342.136828
ΔH_f, kcal/mol:	29.12
Dipole, Da:	6.78
IP(EA), eV:	-8.93(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-[(4-phenylphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=CC=CC=C1/C=C/C2=NN=C(O2)CC3=CC=CC=C3

DOS

IR

Vibrations