Geometry & MOs

Info

ID:	426891
PubChem CID:	135154372
Reduced:	N3O5H27C28 (1)
Stoich.:	A3B5C27D28 (1)
Weight, g/mol:	459.22704
ΔH_f, kcal/mol:	-126.05
Dipole, Da:	2.8
IP(EA), eV:	-9.49(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(6-methoxypyridin-3-yl)oxypiperidin-1-yl]-3-methyl-6-(pyridin-4-ylmethyl)-7,8-dihydro-1,6-naphthyridin-5-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=NC(C(=O)N1CC2=CC(=CC=C2)C(=O)O)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations