Geometry & MOs

Info

ID:	77854
PubChem CID:	49661778
Reduced:	SN4O4C19H30 (1)
Stoich.:	AB4C4D19E30 (1)
Weight, g/mol:	442.203862
ΔH_f, kcal/mol:	-153.85
Dipole, Da:	3.85
IP(EA), eV:	-8.87(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-1-(3-piperidin-1-ylsulfonylpyridin-2-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1CCN(CC1)C2=C(C=CC=N2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations