Geometry & MOs

Info

ID:	354871
PubChem CID:	127287631
Reduced:	O2N5C12H17 (1)
Stoich.:	A2B5C12D17 (1)
Weight, g/mol:	238.142976
ΔH_f, kcal/mol:	48.83
Dipole, Da:	3.78
IP(EA), eV:	-9.68(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(azetidin-1-yl)-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-ylamino]ethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NCC2=NC(=NO2)C3CC3

DOS

IR

Vibrations