Geometry & MOs

Info

ID:	424076
PubChem CID:	135121207
Reduced:	ClO2N3H18C20 (1)
Stoich.:	AB2C3D18E20 (1)
Weight, g/mol:	392.196074
ΔH_f, kcal/mol:	9.16
Dipole, Da:	2.5
IP(EA), eV:	-8.62(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(6-methoxypyridin-3-yl)-8-pyrazolidin-3-yl-1,7-naphthyridin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC(C)C1=COC(=C1)C2=NC3=C(N=C(C=C3N2)C4=CC=CC=C4Cl)OC

DOS

IR

Vibrations