Geometry & MOs

Info

ID:	366147
PubChem CID:	127319549
Reduced:	N2S2O4C15H18 (1)
Stoich.:	A2B2C4D15E18 (1)
Weight, g/mol:	317.055564
ΔH_f, kcal/mol:	-130.92
Dipole, Da:	3.46
IP(EA), eV:	-8.93(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-2-(4-fluorophenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CC=CS2)CC(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations