Geometry & MOs

Info

ID:	88999
PubChem CID:	49958624
Reduced:	ClN2O4H15C17 (1)
Stoich.:	AB2C4D15E17 (1)
Weight, g/mol:	250.050905
ΔH_f, kcal/mol:	-49.0
Dipole, Da:	5.27
IP(EA), eV:	-8.89(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC=CC=C1OCC2=NN=C(O2)COC3=CC=C(C=C3)Cl

DOS

IR

Vibrations