Geometry & MOs

Info

ID:	122069
PubChem CID:	50793063
Reduced:	ClSN3O4H20C24 (1)
Stoich.:	ABC3D4E20F24 (1)
Weight, g/mol:	491.115107
ΔH_f, kcal/mol:	-89.47
Dipole, Da:	11.81
IP(EA), eV:	-9.06(-1.24)
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-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations