Geometry & MOs

Info

ID:	368829
PubChem CID:	127330639
Reduced:	SN2O2C17H22 (1)
Stoich.:	AB2C2D17E22 (1)
Weight, g/mol:	333.114713
ΔH_f, kcal/mol:	-84.79
Dipole, Da:	5.7
IP(EA), eV:	-8.61(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-yl)-2-(4-ethyl-2,3-dioxopiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CSC2=CC=CC=C12)NC(=O)C3CCCC3

DOS

IR

Vibrations