Geometry & MOs

Info

ID:	138093
PubChem CID:	52312450
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	426.158444
ΔH_f, kcal/mol:	-82.59
Dipole, Da:	3.67
IP(EA), eV:	-9.29(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(7-chloro-6-methyl-10-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,6]naphthyridin-2-ium-2-yl)-N-(4-ethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC[C@@H](C)C(=O)NCC(=O)NC1=NC=C(C=C1)C

DOS

IR

Vibrations