Geometry & MOs

Info

ID:	8988
PubChem CID:	84625
Reduced:	N2O3H8C10 (1)
Stoich.:	A2B3C8D10 (1)
Weight, g/mol:	204.053492
ΔH_f, kcal/mol:	27.69
Dipole, Da:	3.8
IP(EA), eV:	-9.45(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-4-nitro-1-oxidoquinolin-1-ium

Drug info:

PubChemData

Smile

CC1=CC2=[N+](C=CC(=C2C=C1)[N+](=O)[O-])[O-]

DOS

IR

Vibrations