Geometry & MOs

Info

ID:	401901
PubChem CID:	135053277
Reduced:	SO2C5H8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	321.230394
ΔH_f, kcal/mol:	-62.55
Dipole, Da:	3.73
IP(EA), eV:	-8.68(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-2-methyl-6-(11-oxododecyl)-1H-pyridin-4-one

Drug info:

PubChemData

Smile

C1C=CC(CS1=O)O

DOS

IR

Vibrations