Geometry & MOs

Info

ID:	435538
PubChem CID:	135191769
Reduced:	ClSF3N3O3H11C15 (1)
Stoich.:	ABC3D3E3F11G15 (1)
Weight, g/mol:	332.013474
ΔH_f, kcal/mol:	-207.03
Dipole, Da:	5.85
IP(EA), eV:	-9.32(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(4-cyanophenyl)-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1Cl)NC=C2S(=O)(=O)NC3=C(C=C(C=N3)COC(F)F)F

DOS

IR

Vibrations