Geometry & MOs

Info

ID:	195956
PubChem CID:	78753682
Reduced:	N2O4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	427.225977
ΔH_f, kcal/mol:	-13.83
Dipole, Da:	8.32
IP(EA), eV:	-8.69(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-4-[(4-piperidin-1-ylphenyl)methylidene]-2,3-dihydro-1H-benzo[b][1,6]naphthyridin-2-ium-10-carboxylate

Drug info:

PubChemData

Smile

C1COCCN1C2=CC=C(C=C2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations