Geometry & MOs

Info

ID:	201975
PubChem CID:	79611623
Reduced:	N2C19H28 (1)
Stoich.:	A2B19C28 (1)
Weight, g/mol:	308.086449
ΔH_f, kcal/mol:	7.05
Dipole, Da:	4.02
IP(EA), eV:	-8.71(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylsulfonylpiperidin-3-yl)methyl]-1,1-dioxo-2,3-dihydrothiophen-3-amine

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2CN(C1)CCC3CC4CCC(C3)N4

DOS

IR

Vibrations