Geometry & MOs

Info

ID:	368815
PubChem CID:	127330243
Reduced:	SN2O3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	344.119464
ΔH_f, kcal/mol:	-120.06
Dipole, Da:	6.62
IP(EA), eV:	-8.46(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-yl)-2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CSC2=CC=CC=C12)N3C(=O)C4CCCCC4C3=O

DOS

IR

Vibrations