Geometry & MOs

Info

ID:	122485
PubChem CID:	50808805
Reduced:	ClSN2O3C17H25 (1)
Stoich.:	ABC2D3E17F25 (1)
Weight, g/mol:	424.158742
ΔH_f, kcal/mol:	-137.52
Dipole, Da:	5.18
IP(EA), eV:	-9.69(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-chlorophenyl)methylsulfonyl]-N-[2-(cyclohexen-1-yl)ethyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C1CCCN(C1)S(=O)(=O)CC2=CC=CC=C2Cl

DOS

IR

Vibrations