Geometry & MOs

Info

ID:	122071
PubChem CID:	50793104
Reduced:	SN3O6H19C24 (1)
Stoich.:	AB3C6D19E24 (1)
Weight, g/mol:	495.101955
ΔH_f, kcal/mol:	-133.82
Dipole, Da:	10.33
IP(EA), eV:	-8.66(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-chlorophenyl)sulfonyl-7-methyl-4-oxo-1,8-naphthyridin-1-yl]-N-(2-ethylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2CC(=O)NC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5

DOS

IR

Vibrations