Geometry & MOs

Info

ID:	129327
PubChem CID:	51072262
Reduced:	ClFSO3C8H8 (1)
Stoich.:	ABCD3E8F8 (1)
Weight, g/mol:	166.110613
ΔH_f, kcal/mol:	-148.54
Dipole, Da:	2.81
IP(EA), eV:	-9.43(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-aminopropyl)-6-methylpyridin-2-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1OCCS(=O)(=O)Cl)F

DOS

IR

Vibrations