Geometry & MOs

Info

ID:	270472
PubChem CID:	103636726
Reduced:	ClION2C14H16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	227.126991
ΔH_f, kcal/mol:	1.6
Dipole, Da:	4.86
IP(EA), eV:	-9.72(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-2-propoxyacetamide

Drug info:

PubChemData

Smile

CC(C)CN(CCC#N)C(=O)C1=C(C=CC(=C1)Cl)I

DOS

IR

Vibrations