Geometry & MOs

Info

ID:	88969
PubChem CID:	49958349
Reduced:	N3O4H11C15 (1)
Stoich.:	A3B4C11D15 (1)
Weight, g/mol:	327.085521
ΔH_f, kcal/mol:	27.34
Dipole, Da:	1.97
IP(EA), eV:	-9.27(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-nitrophenoxy)methyl]-5-(phenoxymethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations