Geometry & MOs

Info

ID:	180667
PubChem CID:	76665672
Reduced:	O2N5C29H35 (1)
Stoich.:	A2B5C29D35 (1)
Weight, g/mol:	461.161853
ΔH_f, kcal/mol:	-43.64
Dipole, Da:	5.61
IP(EA), eV:	-8.04(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-6-(5-methoxypyridin-3-yl)-8-(4-piperidin-4-ylanilino)-8aH-2,7-naphthyridin-1-one

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)C2=CC=C(C=C2)NC3C4C(CCNC4=O)CC(N3)C5=CC6=C(C=C5)NC=C6

DOS

IR

Vibrations