Geometry & MOs

Info

ID:	248749
PubChem CID:	103084101
Reduced:	BrON3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	351.09462
ΔH_f, kcal/mol:	15.3
Dipole, Da:	2.85
IP(EA), eV:	-9.46(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(4-bromo-2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-ethylpentan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Br)C2=NOC(=N2)C(C(C)C)C(C)N

DOS

IR

Vibrations