Geometry & MOs

Info

ID:	407875
PubChem CID:	135080630
Reduced:	PC6H9O9 (1)
Stoich.:	AB6C9D9 (1)
Weight, g/mol:	258.014069
ΔH_f, kcal/mol:	-348.18
Dipole, Da:	5.24
IP(EA), eV:	-10.83(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S,5R)-2,4-dihydroxy-5-(phosphonooxymethyl)oxolane-2-carboxylic acid

Drug info:

PubChemData

Smile

C1[C@@H]([C@H](OC1(C(=O)O)O)COP(=O)([O-])[O-])O

DOS

IR

Vibrations