Geometry & MOs

Info

ID:	435544
PubChem CID:	135191776
Reduced:	ClSF2O2N3H8C13 (1)
Stoich.:	ABC2D2E3F8G13 (1)
Weight, g/mol:	381.976124
ΔH_f, kcal/mol:	-101.28
Dipole, Da:	4.02
IP(EA), eV:	-9.19(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(4-fluoro-2,1,3-benzothiadiazol-7-yl)-1H-indole-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)NS(=O)(=O)C2=CNC3=C2C=CC(=N3)Cl)F

DOS

IR

Vibrations