Geometry & MOs

Info

ID:	283859
PubChem CID:	104013556
Reduced:	F3N4C12H13 (1)
Stoich.:	A3B4C12D13 (1)
Weight, g/mol:	260.163711
ΔH_f, kcal/mol:	-70.0
Dipole, Da:	8.92
IP(EA), eV:	-9.41(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3,5-dimethylpyridin-2-yl)-1,2,4-oxadiazol-5-yl]pentan-3-amine

Drug info:

PubChemData

Smile

CN1C=NN=C1CCNCC2=CC(=C(C=C2F)F)F

DOS

IR

Vibrations