Geometry & MOs

Info

ID:	274253
PubChem CID:	103808039
Reduced:	ON2F3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	300.144948
ΔH_f, kcal/mol:	-191.41
Dipole, Da:	4.35
IP(EA), eV:	-9.03(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)C(F)(F)F)C(=O)[C@H]2CCCCN2

DOS

IR

Vibrations