Geometry & MOs

Info

ID:	150736
PubChem CID:	53790432
Reduced:	NOC9H15 (1)
Stoich.:	ABC9D15 (1)
Weight, g/mol:	418.152872
ΔH_f, kcal/mol:	-52.44
Dipole, Da:	2.44
IP(EA), eV:	-9.01(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxy-2-methyl-3-[(naphthalen-1-ylamino)methylidene]-4-oxo-2H-quinoline-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)[C@H]1CN2CCC1CC2

DOS

IR

Vibrations