Geometry & MOs

Info

ID:	159988
PubChem CID:	57304332
Reduced:	ClNO2C6H10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	303.073871
ΔH_f, kcal/mol:	-87.44
Dipole, Da:	5.82
IP(EA), eV:	-10.09(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[1-(2-azidoethyl)piperidin-1-ium-1-yl] trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1CCN(C(C1)C(=O)O)Cl

DOS

IR

Vibrations