Geometry & MOs

Info

ID:	88904
PubChem CID:	49957582
Reduced:	N3O5H13C16 (1)
Stoich.:	A3B5C13D16 (1)
Weight, g/mol:	362.126657
ΔH_f, kcal/mol:	-4.85
Dipole, Da:	3.81
IP(EA), eV:	-8.62(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methoxyphenoxy)methyl]-5-(naphthalen-2-yloxymethyl)-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OCC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations