Geometry & MOs

Info

ID:	52287
PubChem CID:	12015106
Reduced:	ClN2S2O4C11H11 (1)
Stoich.:	AB2C2D4E11F11 (1)
Weight, g/mol:	333.984877
ΔH_f, kcal/mol:	-148.47
Dipole, Da:	2.28
IP(EA), eV:	-9.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-(4-chlorophenyl) 3-methylsulfonyl-2-oxoimidazolidine-1-carbothioate

Drug info:

PubChemData

Smile

CS(=O)(=O)N1CCN(C1=O)C(=O)SC2=CC=CC=C2Cl

DOS

IR

Vibrations