Geometry & MOs

Info

ID:	122070
PubChem CID:	50793103
Reduced:	SN3O6H21C25 (1)
Stoich.:	AB3C6D21E25 (1)
Weight, g/mol:	477.099457
ΔH_f, kcal/mol:	-143.79
Dipole, Da:	9.93
IP(EA), eV:	-8.63(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(benzenesulfonyl)-7-methyl-4-oxo-1,8-naphthyridin-1-yl]-N-(1,3-benzodioxol-5-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2CC(=O)NC3=CC4=C(C=C3)OCCO4)S(=O)(=O)C5=CC=CC=C5

DOS

IR

Vibrations