Geometry & MOs

Info

ID:	353578
PubChem CID:	127285155
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	391.156577
ΔH_f, kcal/mol:	-103.45
Dipole, Da:	4.43
IP(EA), eV:	-9.1(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoyl]piperidin-4-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations