Geometry & MOs

Info

ID:	206091
PubChem CID:	80201497
Reduced:	N5C13H13 (1)
Stoich.:	A5B13C13 (1)
Weight, g/mol:	267.99597
ΔH_f, kcal/mol:	107.67
Dipole, Da:	8.4
IP(EA), eV:	-8.93(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNC1=NN=C(C=C1)C2=CN=CC(=C2)C#N

DOS

IR

Vibrations