Geometry & MOs

Info

ID:	89034
PubChem CID:	49958834
Reduced:	NOC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	11.18
Dipole, Da:	5.24
IP(EA), eV:	-9.01(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-[(E)-2-(2-methoxyphenyl)ethenyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)OCC2=NN=C(O2)CC3=CC=CC=C3

DOS

IR

Vibrations