Geometry & MOs

Info

ID:	54245
PubChem CID:	16956708
Reduced:	ClSN3O3H18C20 (1)
Stoich.:	ABC3D3E18F20 (1)
Weight, g/mol:	384.99125
ΔH_f, kcal/mol:	-50.6
Dipole, Da:	9.64
IP(EA), eV:	-8.59(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-fluoro-3-(thiophen-2-ylmethylsulfamoyl)-1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C=CN=C(C2=O)SCC(=O)NC3=C(C=CC(=C3)Cl)OC

DOS

IR

Vibrations