Geometry & MOs

Info

ID:	10052
PubChem CID:	96582
Reduced:	NCl2O2H3C9 (1)
Stoich.:	AB2C2D3E9 (1)
Weight, g/mol:	226.954084
ΔH_f, kcal/mol:	-15.33
Dipole, Da:	3.49
IP(EA), eV:	-10.25(-2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dichloroquinoline-5,8-dione

Drug info:

PubChemData

Smile

C1=CC2=C(C(=O)C(=C(C2=O)Cl)Cl)N=C1

DOS

IR

Vibrations