Geometry & MOs

Info

ID:	121226
PubChem CID:	50759398
Reduced:	ClN2O3H19C24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	422.058883
ΔH_f, kcal/mol:	-31.83
Dipole, Da:	6.49
IP(EA), eV:	-8.89(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorobenzoyl)-1-[(3-chlorophenyl)methyl]-7-methyl-1,8-naphthyridin-4-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2CC3=CC=C(C=C3)Cl)C(=O)C4=CC=CC=C4OC

DOS

IR

Vibrations