Geometry & MOs

Info

ID:	366126
PubChem CID:	127319487
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	372.095535
ΔH_f, kcal/mol:	-96.9
Dipole, Da:	9.36
IP(EA), eV:	-9.57(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorophenyl)-N-(1,1-dioxothian-3-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC2=CC=CC3=C2N=CC=C3

DOS

IR

Vibrations