Geometry & MOs

Info

ID:	11548
PubChem CID:	117420
Reduced:	MgC12O12H14 (1)
Stoich.:	AB12C12D14 (1)
Weight, g/mol:	374.033568
ΔH_f, kcal/mol:	-517.63
Dipole, Da:	1.76
IP(EA), eV:	-9.54(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

magnesium;(5R)-5-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-4-oxofuran-2-olate

Drug info:

PubChemData

Smile

C([C@@H]([C@@H]1C(=O)C(=C(O1)[O-])O)O)O.C([C@@H]([C@@H]1C(=O)C(=C(O1)[O-])O)O)O.[Mg+2]

DOS

IR

Vibrations