Geometry & MOs

Info

ID:	341114
PubChem CID:	127263549
Reduced:	Cl2N2O2C7H18 (1)
Stoich.:	A2B2C2D7E18 (1)
Weight, g/mol:	233.043041
ΔH_f, kcal/mol:	-179.3
Dipole, Da:	0.56
IP(EA), eV:	-9.75(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(trifluoromethyl)piperidine-4-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(O)O.Cl.Cl

DOS

IR

Vibrations