Geometry & MOs

Info

ID:	89216
PubChem CID:	49959974
Reduced:	N4O7H12C16 (1)
Stoich.:	A4B7C12D16 (1)
Weight, g/mol:	238.050905
ΔH_f, kcal/mol:	-6.57
Dipole, Da:	4.34
IP(EA), eV:	-9.05(-2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OCC2=NN=C(O2)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations