Geometry & MOs

Info

ID:	288386
PubChem CID:	104316044
Reduced:	BrON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	352.08987
ΔH_f, kcal/mol:	47.0
Dipole, Da:	4.16
IP(EA), eV:	-9.27(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(5-bromopyridin-2-yl)-1,2,4-oxadiazol-5-yl]-N-propylpentan-2-amine

Drug info:

PubChemData

Smile

CCCNC1CCCC1C2=NC(=NO2)C3=NC=C(C=C3)Br

DOS

IR

Vibrations