Geometry & MOs

Info

ID:	228791
PubChem CID:	87565790
Reduced:	O8C9H18 (1)
Stoich.:	A8B9C18 (1)
Weight, g/mol:	393.205242
ΔH_f, kcal/mol:	-363.54
Dipole, Da:	4.66
IP(EA), eV:	-10.13(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5,6-diethylpyridin-3-yl)-3-[3-ethyl-2-methoxy-5-methyl-4-(oxiran-2-yl)phenyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

COC(CC(=O)O)C(=O)O.C(COCCO)O

DOS

IR

Vibrations