Geometry & MOs

Info

ID:	366151
PubChem CID:	127319560
Reduced:	N2S2O4C13H18 (1)
Stoich.:	A2B2C4D13E18 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-155.8
Dipole, Da:	6.79
IP(EA), eV:	-9.64(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopent-2-en-1-yl-N-(1,1-dioxothian-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CCNC(=O)C2=CSC=C2

DOS

IR

Vibrations