Geometry & MOs

Info

ID:	17857
PubChem CID:	523798
Reduced:	NOC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	198.136828
ΔH_f, kcal/mol:	-92.16
Dipole, Da:	3.01
IP(EA), eV:	-8.84(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-diethyl-5-methyl-1,3,4-oxadiazol-3-yl)propan-1-one

Drug info:

PubChemData

Smile

CCC(=O)N1C(OC(=N1)C)(CC)CC

DOS

IR

Vibrations