Geometry & MOs

Info

ID:	23595
PubChem CID:	604768
Reduced:	NOH4C5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	188.058578
ΔH_f, kcal/mol:	-0.59
Dipole, Da:	4.22
IP(EA), eV:	-9.2(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-oxidoquinolin-1-ium-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CC=[N+]2[O-])C(=O)N

DOS

IR

Vibrations