Geometry & MOs

Info

ID:	274284
PubChem CID:	103808295
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	302.124212
ΔH_f, kcal/mol:	-87.97
Dipole, Da:	4.92
IP(EA), eV:	-8.82(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(C)NC(=O)[C@H]2CCCCN2

DOS

IR

Vibrations