Geometry & MOs

Info

ID:	250920
PubChem CID:	103100003
Reduced:	ClN2O2S3C11H15 (1)
Stoich.:	AB2C2D3E11F15 (1)
Weight, g/mol:	359.982769
ΔH_f, kcal/mol:	-29.55
Dipole, Da:	6.82
IP(EA), eV:	-9.01(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-chloro-4-methylthiophen-2-yl)sulfonyl-methylamino]benzenecarbothioamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)N(CCC(=S)N)C2CC2)Cl

DOS

IR

Vibrations