Geometry & MOs

Info

ID:	288073
PubChem CID:	104310431
Reduced:	BrON4H5C7 (1)
Stoich.:	ABC4D5E7 (1)
Weight, g/mol:	350.07422
ΔH_f, kcal/mol:	73.25
Dipole, Da:	4.46
IP(EA), eV:	-9.78(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromopyridin-2-yl)-5-(2-piperidin-3-ylpropyl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1=CC(=NC=C1Br)C2=NOC(=N2)N

DOS

IR

Vibrations