Geometry & MOs

Info

ID:	69721
PubChem CID:	47205249
Reduced:	BrN2S2O4C11H11 (1)
Stoich.:	AB2C2D4E11F11 (1)
Weight, g/mol:	316.001006
ΔH_f, kcal/mol:	-90.14
Dipole, Da:	3.02
IP(EA), eV:	-9.58(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-sulfamoylthiophen-2-yl)ethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=C(SC(=C1)S(=O)(=O)N)CCNC(=O)C2=CC=C(O2)Br

DOS

IR

Vibrations