Geometry & MOs

Info

ID:	366176
PubChem CID:	127319585
Reduced:	N3S3O4C14H17 (1)
Stoich.:	A3B3C4D14E17 (1)
Weight, g/mol:	313.080636
ΔH_f, kcal/mol:	-131.71
Dipole, Da:	6.67
IP(EA), eV:	-9.38(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(2-methylphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CSCC2=CC(=O)N3C=CSC3=N2

DOS

IR

Vibrations