Geometry & MOs

Info

ID:	88972
PubChem CID:	49958393
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	391.99272
ΔH_f, kcal/mol:	8.57
Dipole, Da:	3.79
IP(EA), eV:	-9.03(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromo-2-chlorophenoxy)methyl]-5-(2-phenylethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN=C(O2)CCC3=CC=CC=C3

DOS

IR

Vibrations