Geometry & MOs

Info

ID:	250164
PubChem CID:	103094584
Reduced:	ClN2O2H9C11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	252.03017
ΔH_f, kcal/mol:	-36.38
Dipole, Da:	1.56
IP(EA), eV:	-9.55(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloropyridin-2-yl)-8-oxa-3-azabicyclo[3.2.1]octane-2,4-dione

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(C1=O)C2=C(C=CC=N2)Cl)C

DOS

IR

Vibrations