Geometry & MOs

Info

ID:	52166
PubChem CID:	12014962
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	201.040187
ΔH_f, kcal/mol:	-128.42
Dipole, Da:	2.3
IP(EA), eV:	-9.82(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-oxo-4-pyridin-3-ylbutanoate

Drug info:

PubChemData

Smile

CC1(COC(OC1O)C2=CC=CC=C2)C

DOS

IR

Vibrations