Geometry & MOs

Info

ID:	357243
PubChem CID:	127293759
Reduced:	SN3O3C18H27 (1)
Stoich.:	AB3C3D18E27 (1)
Weight, g/mol:	375.198048
ΔH_f, kcal/mol:	-132.51
Dipole, Da:	5.28
IP(EA), eV:	-9.32(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(1-cyclopentylpyrrolidin-3-yl)amino]-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(CC(=O)NC2CCCOC2)CC(=O)NC3=NC=CS3

DOS

IR

Vibrations