Accuracy

li(plus)(h2o)5.oh   1437 Li(+)(H2O)5.OH

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    #  Species Formula
  1427 LiHCO3.2H2O (Geo)H5LiCO5
  1428 Tartronic acidC3H4O5
  1429 1,3,5,7,9-pentaoxecaneC5H10O5
  1430 3,5,7,9,11-Pentaoxa-tridecaneC8H18O5
  1431 15-Crown-5C10H20O5
  1432 LiNO3.2H2OH4LiNO5
  1433 LiNO3.2H2O (Geo)H4LiNO5
  1434 Dinitrogen pentoxideN2O5
  1435 SER-SERC6H12N2O5
  1436 THR-THRC8H16N2O5
  1437 Li(+)(H2O)5.OH H11LiO6
  1438 Li(+)(H2O)5.OH (Geo)H11LiO6
  1439 Li(+)(H2O)6H12LiO6
  1440 Li(+)(H2O)6 (Geo)H12LiO6
  1441 B3O3(OH)3H3B3O6
  1442 Tri-acetyl borate (Geo)H9BC6O6
  1443 Tri-acetyl borateH9BC6O6
  1444 Trimethyl methanetricarboxylateC7H10O6
  1445 Triethyl methanetricarboxylateC10H16O6
  1446 Triethyl 1,1,1-ethanetricarboxylateC11H18O6
  1447 Li(I)O6(+) (COLGEP) (Geo)H30LiC12O6


ΔHf: -375.7 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 PM7
Li(+)(H2O)5.OH
 H=-375.7 HR=PW91D
 Li     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     3.96985660 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     3.86739017 +1   49.1315482 +1    0.0000000 +0     1     2     0
  O     2.20267745 +1   85.2803403 +1   29.0495537 +1     1     2     3
  O     3.33928284 +1   40.4457338 +1   31.1634279 +1     1     2     4
  O     2.07333967 +1   62.7290221 +1   56.1184958 +1     1     2     5
  O     2.16939169 +1   39.5302263 +1 -176.6975964 +1     1     2     6
  H     0.94879974 +1  100.2506172 +1 -163.5598816 +1     2     1     3
  H     1.01070882 +1   60.6654464 +1  101.2838857 +1     2     1     8
  H     0.95196221 +1  141.4213651 +1  -25.1386893 +1     3     1     2
  H     1.00655102 +1   64.0571985 +1  112.0407930 +1     3     1     7
  H     0.95949368 +1  128.0635565 +1  -80.3791950 +1     4     1     2
  H     1.01086191 +1   95.5991396 +1  111.4146769 +1     4     1    12
  H     0.91859439 +1  121.1917478 +1 -159.8071324 +1     5     2     1
  H     0.93589750 +1  144.8131913 +1  179.3226086 +1     6     1     2
  H     1.08835264 +1   99.5476824 +1  134.9190974 +1     6     1    15
  H     0.98697146 +1  114.1187481 +1  -15.6180161 +1     7     1     2
  H     0.98310791 +1  110.1146490 +1  111.5246988 +1     7     1    17