Geometry & MOs

Info

ID:	184053
PubChem CID:	77104796
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	319.07574
ΔH_f, kcal/mol:	-88.06
Dipole, Da:	5.2
IP(EA), eV:	-8.94(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-5-[3-(dimethylamino)piperidin-1-yl]sulfonyl-3H-pyridin-2-one

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1C=CC(=O)N2CC(C2)(C)O

DOS

IR

Vibrations