Geometry & MOs

Info

ID:	88971
PubChem CID:	49958361
Reduced:	Br2N2O3H14C17 (1)
Stoich.:	A2B2C3D14E17 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-10.97
Dipole, Da:	1.95
IP(EA), eV:	-9.34(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-5-(2-phenylethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OCC2=NN=C(O2)COC3=CC=CC=C3)Br)Br

DOS

IR

Vibrations