Geometry & MOs

Info

ID:	208518
PubChem CID:	80539887
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	218.116761
ΔH_f, kcal/mol:	52.78
Dipole, Da:	2.05
IP(EA), eV:	-9.57(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)butan-1-amine

Drug info:

PubChemData

Smile

CC(CCN)C1=NC(=NO1)C2=CC=CC=N2

DOS

IR

Vibrations