Geometry & MOs

Info

ID:	14207
PubChem CID:	406641
Reduced:	ClO2S2N3H18C25 (1)
Stoich.:	AB2C2D3E18F25 (1)
Weight, g/mol:	491.052897
ΔH_f, kcal/mol:	39.93
Dipole, Da:	3.47
IP(EA), eV:	-8.99(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-methyl-N-(3-naphthalen-2-ylquinoxalin-2-yl)-2-sulfanylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2C4=CC5=CC=CC=C5C=C4

DOS

IR

Vibrations