Geometry & MOs

Info

ID:	251431
PubChem CID:	103103891
Reduced:	BrSCl2N2O3C10H11 (1)
Stoich.:	ABC2D2E3F10G11 (1)
Weight, g/mol:	325.93945
ΔH_f, kcal/mol:	-109.41
Dipole, Da:	4.85
IP(EA), eV:	-9.78(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromothiophen-2-yl)sulfonyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)S(=O)(=O)C1=C(C=C(C=C1Cl)Br)Cl

DOS

IR

Vibrations