Geometry & MOs

Info

ID:	369076
PubChem CID:	127331218
Reduced:	SN2O2C15H20 (1)
Stoich.:	AB2C2D15E20 (1)
Weight, g/mol:	345.151098
ΔH_f, kcal/mol:	-85.81
Dipole, Da:	3.43
IP(EA), eV:	-8.52(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-yl)-4-(2-oxopyrrolidin-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)(CNC(=O)NC2CSC3=CC=CC=C23)O

DOS

IR

Vibrations