Geometry & MOs

Info

ID:	351386
PubChem CID:	127280274
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	321.166411
ΔH_f, kcal/mol:	-103.04
Dipole, Da:	5.62
IP(EA), eV:	-9.14(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-oxo-N-(2-pyrrolidin-1-ylethyl)-6-(trifluoromethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

DOS

IR

Vibrations