Geometry & MOs

Info

ID:	89276
PubChem CID:	49960195
Reduced:	N2O4H18C21 (1)
Stoich.:	A2B4C18D21 (1)
Weight, g/mol:	334.077599
ΔH_f, kcal/mol:	-27.42
Dipole, Da:	1.6
IP(EA), eV:	-8.68(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(naphthalen-1-yloxymethyl)-5-[(E)-2-thiophen-2-ylethenyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OCC2=NN=C(O2)COC3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations