Geometry & MOs

Info

ID:	288061
PubChem CID:	104310343
Reduced:	FN2O2H13C16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	272.93045
ΔH_f, kcal/mol:	-68.63
Dipole, Da:	8.78
IP(EA), eV:	-9.66(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C2=NC3=C(N2)C=C(C(=C3)C(=O)O)F

DOS

IR

Vibrations