Geometry & MOs

Info

ID:	288088
PubChem CID:	104310697
Reduced:	BrON4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	310.04292
ΔH_f, kcal/mol:	41.58
Dipole, Da:	2.63
IP(EA), eV:	-9.32(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C(C1)C2=NC(=NO2)C3=C(C=CC=N3)Br)N

DOS

IR

Vibrations