Geometry & MOs

Info

ID:	48973
PubChem CID:	11528541
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	202.045332
ΔH_f, kcal/mol:	-8.09
Dipole, Da:	1.74
IP(EA), eV:	-8.04(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;(2S,4S,5R)-2,4,5,6-tetrahydroxyhexanoate

Drug info:

PubChemData

Smile

CN(C)C1=CC2=C(C=CC=C2CO)C=C1

DOS

IR

Vibrations