Geometry & MOs

Info

ID:	421190
PubChem CID:	135115530
Reduced:	FSN4O4C17H21 (1)
Stoich.:	ABC4D4E17F21 (1)
Weight, g/mol:	369.168856
ΔH_f, kcal/mol:	-153.92
Dipole, Da:	4.76
IP(EA), eV:	-9.52(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R)-1-(5,6-dimethyl-2-oxo-1H-pyridine-3-carbonyl)-3-hydroxypiperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

COCC1=NNC(=C1)CNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations