Geometry & MOs

Info

ID:	199244
PubChem CID:	79222398
Reduced:	NOSC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	250.113984
ΔH_f, kcal/mol:	-36.17
Dipole, Da:	2.16
IP(EA), eV:	-8.53(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-phenylsulfanylethylamino)piperidin-2-one

Drug info:

PubChemData

Smile

COC1CCCC1NCC2CC3=CC=CC=C3S2

DOS

IR

Vibrations