Geometry & MOs

Info

ID:	341925
PubChem CID:	127264618
Reduced:	ClNF3C12H15 (1)
Stoich.:	ABC3D12E15 (1)
Weight, g/mol:	265.084512
ΔH_f, kcal/mol:	-181.14
Dipole, Da:	1.24
IP(EA), eV:	-9.11(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[2-(trifluoromethyl)phenyl]piperidine;hydrochloride

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C2=CC=CC=C2C(F)(F)F.Cl

DOS

IR

Vibrations