Geometry & MOs

Info

ID:	288094
PubChem CID:	104310911
Reduced:	BrON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	375.93574
ΔH_f, kcal/mol:	42.5
Dipole, Da:	3.9
IP(EA), eV:	-9.17(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(3,5-dibromopyridin-2-yl)-1,2,4-oxadiazol-5-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

C1CCCC(CC1)(CN)C2=NC(=NO2)C3=C(C=CC=N3)Br

DOS

IR

Vibrations