Geometry & MOs

Info

ID:	274340
PubChem CID:	103808634
Reduced:	ClFN2O2C11H12 (1)
Stoich.:	ABC2D2E11F12 (1)
Weight, g/mol:	300.144948
ΔH_f, kcal/mol:	-112.94
Dipole, Da:	5.95
IP(EA), eV:	-9.08(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-[4-(trifluoromethyl)phenyl]ethyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

C1COC(CN1)C(=O)NC2=C(C=CC(=C2)F)Cl

DOS

IR

Vibrations