Geometry & MOs

Info

ID:	140889
PubChem CID:	52777816
Reduced:	S2O3N5C21H25 (1)
Stoich.:	A2B3C5D21E25 (1)
Weight, g/mol:	392.066463
ΔH_f, kcal/mol:	-44.7
Dipole, Da:	8.18
IP(EA), eV:	-9.0(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-3-sulfamoylphenyl)-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=CC(=C3)C)S(=O)(=O)N

DOS

IR

Vibrations