Geometry & MOs

Info

ID:	309129
PubChem CID:	126538029
Reduced:	ClNC20H28 (1)
Stoich.:	ABC20D28 (1)
Weight, g/mol:	171.053158
ΔH_f, kcal/mol:	-20.86
Dipole, Da:	2.95
IP(EA), eV:	-9.19(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[hydroxy(methoxy)methyl]-3H-pyridine-2,6-dione

Drug info:

PubChemData

Smile

CCCCCCC1=C(C=C2C=NC3CCCCCC3C2=C1)Cl

DOS

IR

Vibrations