Geometry & MOs

Info

ID:	77022
PubChem CID:	48425716
Reduced:	O2F3N5C16H18 (1)
Stoich.:	A2B3C5D16E18 (1)
Weight, g/mol:	282.169191
ΔH_f, kcal/mol:	-170.59
Dipole, Da:	3.98
IP(EA), eV:	-9.42(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)butanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(N(N=C1)C2=CC=CC=N2)C(F)(F)F

DOS

IR

Vibrations