Geometry & MOs

Info

ID:	288078
PubChem CID:	104310486
Reduced:	BrON4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	338.07422
ΔH_f, kcal/mol:	49.84
Dipole, Da:	4.98
IP(EA), eV:	-9.9(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2=NC(=NO2)C3=NC=C(C=C3)Br)N

DOS

IR

Vibrations