Geometry & MOs

Info

ID:	366252
PubChem CID:	127319709
Reduced:	SO3N5C14H17 (1)
Stoich.:	AB3C5D14E17 (1)
Weight, g/mol:	378.161329
ΔH_f, kcal/mol:	-36.21
Dipole, Da:	9.64
IP(EA), eV:	-10.05(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-1-(2-phenylacetyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC2=CC=C(C=C2)N3C=NN=N3

DOS

IR

Vibrations