Mrv1572004191602572D          

  7  4  0  0  0  0            999 V2000
    0.0000    1.6500    0.0000 Fe  0  2  0  0  0  0  0  0  0  0  0  0
   -0.0000   -1.6500    0.0000 Li  0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.0000   -0.8250    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
  7  3  1  0  0  0  0
  7  4  1  0  0  0  0
  7  5  1  0  0  0  0
  7  6  2  0  0  0  0
M  CHG  5   1   2   2   1   3  -1   4  -1   5  -1
M  END
> <DATABASE_ID>
CHEM010354

> <DATABASE_NAME>
chemdb

> <SMILES>
[Li+].[Fe++].[O-]P([O-])([O-])=O

> <INCHI_IDENTIFIER>
InChI=1S/Fe.Li.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+2;+1;/p-3

> <INCHI_KEY>
GELKBWJHTRAYNV-UHFFFAOYSA-K

> <FORMULA>
FeLiO4P

> <MOLECULAR_WEIGHT>
157.75

> <EXACT_MASS>
157.90436

> <JCHEM_ACCEPTOR_COUNT>
4

> <JCHEM_ATOM_COUNT>
7

> <JCHEM_AVERAGE_POLARIZABILITY>
4.932137383430433

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
λ²-iron(2+) ion lithium(1+) ion phosphate

> <JCHEM_LOGP>
-1.0201038226666665

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
6.951626889535468

> <JCHEM_PKA_STRONGEST_ACIDIC>
1.7961261340181292

> <JCHEM_POLAR_SURFACE_AREA>
86.25

> <JCHEM_REFRACTIVITY>
11.2868

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
λ²-iron(2+) ion lithium(1+) ion phosphate

> <JCHEM_VEBER_RULE>
0

> <NAME>
Phosphoric acid, iron(2+) lithium salt (1:1:1)

> <CAS>
15365-14-7

$$$$