Geometry & MOs

Info

ID:	342803
PubChem CID:	127265966
Reduced:	SCl3N3O3C8H8 (1)
Stoich.:	AB3C3D3E8F8 (1)
Weight, g/mol:	349.109627
ΔH_f, kcal/mol:	-101.46
Dipole, Da:	3.65
IP(EA), eV:	-10.3(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[2-(hydroxymethyl)-1-benzofuran-5-yl]-3,5-dimethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC(C(=O)N)NS(=O)(=O)C1=C(N=C(C=C1Cl)Cl)Cl

DOS

IR

Vibrations