Geometry & MOs

Info

ID:	158378
PubChem CID:	56463537
Reduced:	ClN2S2O5C15H23 (1)
Stoich.:	AB2C2D5E15F23 (1)
Weight, g/mol:	404.85266
ΔH_f, kcal/mol:	-211.64
Dipole, Da:	5.18
IP(EA), eV:	-9.86(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5-dibromo-N-(2-ethylsulfonylethyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)NCCS(=O)(=O)CC

DOS

IR

Vibrations