Geometry & MOs

Info

ID:	122083
PubChem CID:	50793124
Reduced:	SN2O3H20C23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	475.156577
ΔH_f, kcal/mol:	-42.31
Dipole, Da:	8.69
IP(EA), eV:	-9.5(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C=C(C(=O)C3=C2N=C(C=C3)C)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations