Geometry & MOs

Info

ID:	6893
PubChem CID:	70409
Reduced:	ON2H12C18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	272.094963
ΔH_f, kcal/mol:	79.67
Dipole, Da:	4.59
IP(EA), eV:	-9.09(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-naphthalen-2-yl-5-phenyl-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C(O2)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations