Geometry & MOs

Info

ID:	165582
PubChem CID:	74570467
Reduced:	SO2N3C9H9 (1)
Stoich.:	AB2C3D9E9 (1)
Weight, g/mol:	220.064354
ΔH_f, kcal/mol:	-29.68
Dipole, Da:	4.17
IP(EA), eV:	-9.34(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

1-ethylsulfonylpiperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)[O-])[NH2+]C1=C2C=CSC2=NC=N1

DOS

IR

Vibrations