Geometry & MOs

Info

ID:	89205
PubChem CID:	49959893
Reduced:	IN2O3H15C17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	326.106671
ΔH_f, kcal/mol:	0.54
Dipole, Da:	6.9
IP(EA), eV:	-8.76(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-2-(4-fluorophenyl)ethenyl]-5-[(2-methoxyphenoxy)methyl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NN=C(O2)COC3=CC=CC=C3OC)I

DOS

IR

Vibrations