Geometry & MOs

Info

ID:	208519
PubChem CID:	80539888
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	46.93
Dipole, Da:	3.19
IP(EA), eV:	-9.65(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]butan-1-amine

Drug info:

PubChemData

Smile

CC(CCN)C1=NC(=NO1)C2=CN=CC=C2

DOS

IR

Vibrations