Geometry & MOs

Info

ID:	250857
PubChem CID:	103099516
Reduced:	ClN2O2S2C13H15 (1)
Stoich.:	AB2C2D2E13F15 (1)
Weight, g/mol:	317.005947
ΔH_f, kcal/mol:	-46.88
Dipole, Da:	5.66
IP(EA), eV:	-8.37(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminopyridin-4-yl)-5-chloro-N,4-dimethylthiophene-2-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)N)NS(=O)(=O)C2=CC(=C(S2)Cl)C)C

DOS

IR

Vibrations