Geometry & MOs

Info

ID:	250903
PubChem CID:	103099865
Reduced:	ClNO2S2C8H12 (1)
Stoich.:	ABC2D2E8F12 (1)
Weight, g/mol:	294.026348
ΔH_f, kcal/mol:	-70.25
Dipole, Da:	4.79
IP(EA), eV:	-9.38(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-4-methylthiophen-2-yl)sulfonyl-4-methylpiperazine

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NC(C)C)Cl

DOS

IR

Vibrations