Geometry & MOs

Info

ID:	288080
PubChem CID:	104310517
Reduced:	BrON6H11C12 (1)
Stoich.:	ABC6D11E12 (1)
Weight, g/mol:	324.05857
ΔH_f, kcal/mol:	100.89
Dipole, Da:	5.57
IP(EA), eV:	-9.72(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Br)C2=NOC(=N2)C(CC3=CN=CN3)N

DOS

IR

Vibrations