Geometry & MOs

Info

ID:	357352
PubChem CID:	127293985
Reduced:	N2O3C23H28 (1)
Stoich.:	A2B3C23D28 (1)
Weight, g/mol:	335.097349
ΔH_f, kcal/mol:	-115.92
Dipole, Da:	5.9
IP(EA), eV:	-8.83(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-oxo-N-(2-thiomorpholin-4-ylsulfonylethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC(C1)C2=O)C(=O)NC3=CC=CC=C3NC(=O)CC4CCC=C4

DOS

IR

Vibrations