Geometry & MOs

Info

ID:	349033
PubChem CID:	127274759
Reduced:	OSN6C20H24 (1)
Stoich.:	ABC6D20E24 (1)
Weight, g/mol:	341.177313
ΔH_f, kcal/mol:	35.82
Dipole, Da:	7.79
IP(EA), eV:	-8.3(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butanoyl-N-(3-oxo-3-piperidin-1-ylpropyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN2C(=NN=C2CNC(=O)C3CCN(CC3)C4=NC5=CC=CC=C5S4)C1

DOS

IR

Vibrations