Geometry & MOs

Info

ID:	366218
PubChem CID:	127319667
Reduced:	S2N3O4C13H19 (1)
Stoich.:	A2B3C4D13E19 (1)
Weight, g/mol:	347.041664
ΔH_f, kcal/mol:	-160.44
Dipole, Da:	10.32
IP(EA), eV:	-9.41(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methylsulfanyl]-N-(1,1-dioxothian-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC(C2=CC=CS2)NC(=O)N

DOS

IR

Vibrations