Selected Cell
Cell:
Value:
Raw data thermotable
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| Entry number. Species or blend | nC | nH | nN | nO | nP | nS | nMg | z | Standard chemical potential: | Source | Enthalpy | Source | |
| 1. AA WATER H2O | kJ/mol | - | kJ/mol | - | |||||||||
| 2. AA11: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.19 | A | -285.83 | A | |
| 3. AA12: H2O species (l) (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.1403161 | C | -285.83 | C | |
| 4. AA13: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.189 | GM0 | -285.83 | G | |
| 5. AA14: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.178 | M | -285.83 | M | |
| 6. AA15: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.1 | R | -285.83 | R | |
| 7. AA16: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.178 | T | -285.83 | A | |
| 8. AA17: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.182592 | W | -285.82996 | W | |
| 9. AA18: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.129 | Z | -285.83 | Z | |
| 10. AA19: H2O species (l) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.141 | U | -285.83 | U | |
| 11. AA20: H2O (l) average | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -237.158656455556 | av. | -285.829995 | average | |
| 11b. AA20: H2O (l) eQuilibrator at pHc=I=0 | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -238.1 | E | -285.829995 | average | |
| 12. AA30 | -237.15865645555556 | ||||||||||||
| 13. AA31: H2O (s) ice (data not avalable_) | |||||||||||||
| 14. AA40 | |||||||||||||
| 15. AA41: H2O (g) (steam) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -228.58187885 | C | -241.826 | C | |
| 16. AA42: H2O (g) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -228.572 | M3 | -241.826 | C | |
| 17. AA43: H2O(g) m(ideal gas) | 0 | 2 | 0 | 1 | 0 | 0 | 0 | 0 | -228.569 | U | -241.841 | U | |
| 18. AA50 | |||||||||||||
| 19. AA51: D2O | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -234.550856 | J | -249.203224 | J | |
| 20. ACETALDEHYDE | |||||||||||||
| 21. acetaldehyde species (aq) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -139 | A | -212.23 | A | |
| 22. acetaldehyde species (aq) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -139.9 | T | -212.23 | A | |
| 23. acetaldehyde species (aq) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -139.07616 | W | -212.23 | W | |
| 24. acetaldehyde species (aq) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -141.04264 | B | -212.23 | A | |
| 25. acetaldehyde species (aq) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -140.1 | E | -212.23 | A | |
| 26. acetaldehyde species (g) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -132.96752 | W | -166.02112 | W | |
| 27. acetaldehyde species (g2) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -128.86 | Z | -166.19 | Z | |
| 28. acetaldehyde-species (l2) | 2 | 4 | 0 | 1 | 0 | 0 | 0 | 0 | -128.12 | Z | -192.3 | Z | |
| 29. ACETATE/ACETIC ACID (AQ) | |||||||||||||
| 30. acetate11: acetic acid (l) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -389.44672 | W | -484.21432000000004 | W | |
| 31. acetate12: acetic acid (l) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -389.9 | Z | -484.21432 | W | |
| 32. acetate20 | |||||||||||||
| 33. acetate21: acetic acid species (aq) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -396.45 | A | -485.76 | A | |
| 34. acetate22: acetate- species | 2 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | -369.31 | A | -486.01 | A | |
| 35. acetate23: acetate/acetic acid blend | 2 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | - | A | - | A | |
| 36. acetate30 | |||||||||||||
| 37. acetate31: acetic acid species (aq) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -404.09072 | W | -485.26032000000004 | W | |
| 38. acetate32: acetate- species | 2 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | -376.89472 | W | -485.59504000000004 | W | |
| 39. acetate33: acetate/acetic acid blend | 2 | 3 | 0 | 2 | 0 | 0 | 0 | ? | - | W | - | W | |
| 40. acetate40 | |||||||||||||
| 41. acetate41: acetic acid-species (aq) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -396.46 | Z | -485.76 | (ao)Z | |
| 42. acetate42: acetate- -species | 2 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | -369.31 | Z | -486.01 | Z | |
| 43. acetate43: acetate/acetic acid blend | 2 | ? | 0 | 2 | 0 | 0 | 0 | ? | - | Z | - | Z | |
| 44. acetate50 | |||||||||||||
| 45. acetate51: acetic acid species (aq) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -399.48832000000004 | M | -485.5 | M | |
| 46. acetate52: acetate- species | 2 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | -372.33416 | M | -486 | M | |
| 47. acetate53: acetate/acetic acid blend | 2 | ? | 0 | 2 | 0 | 0 | 0 | ? | - | M | - | M | |
| 48. acetate60 | |||||||||||||
| 49. acetate61: acetic acid species (aq) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -394.3 | E | -485.76 | A | |
| 50. acetate70 | |||||||||||||
| 51. acetate71: acetic acid (eq, buff) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -417.52136 | W | -485.59504000000004 | W | |
| 52. acetate72: acetic acid (g) | 2 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -374 | Z | -431.87248 | P | |
| 53. ACETOACETATE | |||||||||||||
| 54. acetoacetate- species Alberty has wrong charge of zero with 5 H, should be -1 with 5H as here | 4 | 5 | 0 | 3 | 0 | 0 | 0 | -1 | -482.49 | A | -624.2528 | X<-P | |
| 55. acetoacetic acid | 4 | 6 | 0 | 3 | 0 | 0 | 0 | 0 | -512.2 | E | -624.2528 | P | |
| 56. ACETOACETYLCoA | |||||||||||||
| 57. acetoacetylCoA species | 25 | 40 | 7 | 18 | 3 | 1 | 0 | 0 | -3489.5 | E | -4361.875 | X<-Pacid | |
| 58. acetoacetylCoA as CoA493-difference species | 4 | 5 | 0 | 2 | 0 | 0 | 0 | 0 | -285.32 | A | -624.2528 | X<-Pacid | |
| 58B. acetoacetylCoA as CoA493-difference species minus CoA blend 495 | A | ||||||||||||
| 59. ACETONE | |||||||||||||
| 60. acetone species (aq) | 3 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | -159.7 | AW | -221.71 | AW | |
| 61. acetone species (aq) | 3 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | -159.7 | T | -221.71 | T->A | |
| 62. acetone species (aq) | 3 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | -160.1 | E | -221.71 | T->A | |
| 63. acetone species (g) | 3 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | -152.7 | R | -221.71 | X<-gas | |
| 64. acetone species (l) | 3 | 6 | 0 | 1 | 0 | 0 | 0 | 0 | -153.55280000000002 | W | -246.81416000000002 | W | |
| 65. ACETONITRILE | |||||||||||||
| 66. acetonitrile (g) | 2 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | 82.58 | Z | 65.23 | Z | |
| 67. acetonitrile (l) | 2 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | 77.22 | Z | 31.38 | Z | |
| 68. ACETYLCoA | |||||||||||||
| 69. acetylCoA as CoA493-difference species (This used to be ‘69. acetylcoA species difference with CoA- (unprotonated form)’) | 2 | 3 | 0 | 1 | 0 | 0 | 0 | 0 | -180.36 | A | -486 | XX | |
| 69a. acetylCoA minus CoA- (unprotonated form = entry 493) | 2 | 3 | 0 | 1 | 0 | 0 | 0 | 0 | -180.36 | A | -486 | XX | |
| 69b. acetylCoA69 minus CoAH (protonated form=entry 494) | 2 | 3 | 0 | 1 | 0 | 0 | 0 | 0 | -180.36 | A | -486 | XX | |
| 69c. acetylCoA minus CoA(H) blend (=entry 495) | 2 | 3 | 0 | 1 | 0 | 0 | 0 | 0 | -180.36 | A | -486 | XX | |
| 70. ACETYLPHOSPHATE | |||||||||||||
| 71. acetylphos1 2- species | 2 | 3 | 0 | 5 | 1 | 0 | 0 | -2 | -1219.49 | A | -1800 | XX acetate + phosphate | |
| 72. acetylphos2 - species | 2 | 4 | 0 | 5 | 1 | 0 | 0 | -1 | -1269.08 | A | -1799 | XX acetate + phosphate | |
| 73. acetylphos3 0 species | 2 | 5 | 0 | 5 | 1 | 0 | 0 | 0 | -1298.26 | A | -1798 | XX acetate + phosphate | |
| 74. acetylphos4 blend [H] | 2 | ? | 0 | 5 | 1 | 0 | 0 | ? | - | - | - | - | |
| 75. NO DATA FOR ACETYLPHOSPHATE OMNIBLEND | |||||||||||||
| 76. acetylphos6 0 species | 2 | 4 | 0 | 5 | 1 | 0 | 0 | -1 | -1276.1 | E | -1798 | XX acetate + phosphate | |
| 77. ACONITATEcis | |||||||||||||
| 78. aconitatecis11 3- species (aq) | 6 | 3 | 0 | 6 | 0 | 0 | 0 | -3 | -917.13 | AW | -1224.7 | X<-cr | |
| 79. aconitatecis12 3- species (aq) | 6 | 3 | 0 | 6 | 0 | 0 | 0 | -3 | -922.61 | T | -1224.7 | X<-cr | |
| 80. aconitatecis13 3- species (aq) | 6 | 3 | 0 | 6 | 0 | 0 | 0 | -3 | -920.02 | M3 | -1224.6568 | X<-cr | |
| 81. aconitatecis14 2- species (aq) | 6 | 4 | 0 | 6 | 0 | 0 | 0 | -2 | -930.86 | M3 | -1224.7 | M | |
| 82. aconitatecis15 - species (aq) | 6 | 5 | 0 | 6 | 0 | 0 | 0 | -1 | -955.41 | M3 | -1224.7 | M | |
| 83. aconitatecis16 neutral species (aq) | 6 | 6 | 0 | 6 | 0 | 0 | 0 | 0 | -991.94 | M3 | -1224.7 | M | |
| 84. aconitatecis17 blend | 6 | ? | 0 | 6 | 0 | 0 | 0 | ? | - | M3 | -1224.7 | <M | |
| 85. NO DATA FOR ACONITATE OMNIBLEND | |||||||||||||
| 86. aconitatecis19 neutral -species (aq) | 6 | 6 | 0 | 6 | 0 | 0 | 0 | 0 | -978.4 | E | -1224.7 | M | |
| 87. ACONITATEtrans | |||||||||||||
| 88. aconitatetrans2: trans-aconitic acid neutral species | 6 | 6 | 0 | 6 | 0 | 0 | 0 | 0 | -983.1 | E | -1224.7 | E<C cr | |
| 89. ACRYLATE | |||||||||||||
| 90. acrylate- Thauer gives estimate) | 3 | 3 | 0 | 2 | 0 | 0 | 0 | -1 | -286.19 | T | -400 | XX acetate + phosphate | |
| 91. acrylic acid (aq) | 3 | 4 | 0 | 2 | 0 | 0 | 0 | 0 | -295.9 | E | -303.38184 | X<-propanol | |
| 92. ACRYLONITRILE | |||||||||||||
| 93. acrylonitrile (g) | 3 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | 91.9 | R | 31.38 | R->Z | |
| 94. acrylonitrile (l) | 3 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | 86.5 | R | 31.38 | R->Z | |
| 95. ADENINE | |||||||||||||
| 96. adenine10 (cr) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 300.4112 | W | 97.0688 | W | |
| 97. adenine11 (cr) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 299.3 | O | 96 | O | |
| 98. adenine12 | |||||||||||||
| 99. adenine13 (eq,buf) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 312.29376 | W | 129.5 | X<-A | |
| 100. adenine14 | |||||||||||||
| 101. adenine15 0 species (aq) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 313.4 | A | 129.5 | A | |
| 102. adenine16 + species | 5 | 6 | 5 | 0 | 0 | 0 | 0 | 1 | 289.43 | A | 109.4 | <-W | |
| 103. adenine17 blend | 5 | ? | 5 | 0 | 0 | 0 | ? | - | A | - | <-W | ||
| 104. adenine18 | |||||||||||||
| 105. adenine19 - species | 5 | 4 | 5 | 0 | 0 | 0 | 0 | -1 | 368.65224 | W | 169.9 | W->O | |
| 106. adenine20 species (aq) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 312.29376 | W | 129.5 | W->O | |
| 107. adenine21 + species | 5 | 6 | 5 | 0 | 0 | 0 | 0 | 1 | 288.31944 | W | 109.4 | W->O | |
| 108. adenine22 blend | 5 | ? | 5 | 0 | 0 | 0 | 0 | ? | - | W | - | W->O | |
| 109. adenine30 | |||||||||||||
| 110. adenine31- species | 5 | 4 | 5 | 0 | 0 | 0 | 0 | -1 | 367.6 | O | 169.9 | O | |
| 111. adenine32 species (aq) | 5 | 5 | 5 | 0 | 0 | 0 | 0 | 0 | 311.3 | O | 129.5 | O | |
| 112. adenine33+ species | 5 | 6 | 5 | 0 | 0 | 0 | 0 | 1 | 287.3 | O | 109.4 | O | |
| 113. adenine34 blend | 5 | ? | 5 | 0 | 0 | 0 | 0 | ? | - | O | - | O | |
| 114. ADENOSINE | |||||||||||||
| 115. adenosine 10 species | 10 | 13 | 5 | 4 | 0 | 0 | 0 | 0 | -194.5 | AG | -621.3 | A | |
| 116. adenosine 2 + species | 10 | 14 | 5 | 4 | 0 | 0 | 0 | 1 | -214.28 | A | -637.7 | A | |
| 117. adenosine 3 blend | 10 | ? | 5 | 4 | 0 | 0 | 0 | ? | - | A | - | A | |
| 118. adenosine 4 + species | 10 | 14 | 5 | 4 | 0 | 0 | 0 | 1 | -213.5 | E | -637.7 | <A | |
| 119. ADENOSINE99 | |||||||||||||
| 120. adenosinephosphosulfate2--species NOTE Molecule is ill defined Alberty takes this as 1- and 12H, but it should be -2 according to wiki and structure. Here assumed to be PUBCHEM CID: 129675857 | 10 | 13 | 5 | 10 | 1 | 1 | 0 | -1 | -1541.98 | A | -1927.475 | XHtr | |
| 121. ADP | |||||||||||||
| 122. ADP11: adp3- species | 10 | 12 | 5 | 10 | 2 | 0 | 0 | -3 | -1906.13 | A | -2626.54 | A | |
| 123. ADP12: hadp2- species | 10 | 13 | 5 | 10 | 2 | 0 | 0 | -2 | -1947.1 | A | -2620.94 | A | |
| 124. ADP13: h2adp- species | 10 | 14 | 5 | 10 | 2 | 0 | 0 | -1 | -1971.98 | A | -2638.54 | A | |
| 125. ADP14: MgADP- | 10 | 12 | 5 | 10 | 2 | 0 | 1 | -1 | -2387.97 | A | -3074.54 | A | |
| 126. ADP15: MgHADP | 10 | 13 | 5 | 10 | 2 | 0 | 1 | 0 | -2416.67 | A | -3075.44 | A | |
| 127. ADP16: adp blend [H+, A] | 10 | ? | 5 | 10 | 2 | 0 | 0 | ? | - | A | - | A | |
| 128. ADP17: adp omniblend [H+Mg, A] | 10 | ? | 5 | 10 | 2 | 0 | ? | ? | - | A | - | A | |
| 129. ADP20: H4adp+ species pH dependence at pH0 is 16 | 10 | 16 | 5 | 10 | 2 | 0 | 0 | 1 | -1996.4 | E | -2638.54 | E<XXH2ADP | |
| 130. ADP30: adp3- species | 10 | 12 | 5 | 10 | 2 | 0 | 0 | -3 | -1906.13 | G | -2626.54 | G | |
| 131. ADP31: hadp2- species | 10 | 13 | 5 | 10 | 2 | 0 | 0 | -2 | -1947.1 | G | -2620.94 | G | |
| 132. ADP32: h2adp- species | 10 | 14 | 5 | 10 | 2 | 0 | 0 | -1 | -1971.98 | G | -2638.54 | G | |
| 133. ADP33: MgADP- | 10 | 12 | 5 | 10 | 2 | 0 | 1 | -1 | -2388.06 | G | -3074.54 | G | |
| 134. ADP34: MgHADP | 10 | 13 | 5 | 10 | 2 | 0 | 1 | 0 | -2416.77 | G | -3075.44 | G | |
| 135. ADP35: adp-blend [H+, G] | 10 | 13 | 5 | 10 | 2 | 0 | - | G | - | G | |||
| 136. ADP36: adp-omniblend [HMg, G] | 10 | 13 | 5 | 10 | 2 | 0 | - | G | - | - | |||
| 137. ADP40: adp3- species | 10 | 12 | 5 | 10 | 2 | 0 | 0 | -3 | -1900.3 | O | -2620.8 | O | |
| 138. ADP41: hadp2- species | 10 | 13 | 5 | 10 | 2 | 0 | 0 | -2 | -1940.3 | O | -2616.8 | O | |
| 139. ADP42:h2adp- species | 10 | 14 | 5 | 10 | 2 | 0 | 0 | -1 | -1980.2 | O | -2653.3 | O | |
| 140. ADP43: MgADP- | 10 | 12 | 5 | 10 | 2 | 0 | 1 | -1 | -2372.1 | O | -3071.3 | O | |
| 141. ADP44: MgHADP | 10 | 13 | 5 | 10 | 2 | 0 | 1 | 0 | -2412 | O | -3072.5 | O | |
| 142. ADP45: adp blend [H+, O] | 10 | ? | 5 | 10 | 2 | 0 | 0 | ? | - | O | - | O | |
| 143. ADP46: adp-omniblend [H+Mg, O] | 10 | ? | 5 | 10 | 2 | 0 | ? | ? | - | O | - | O | |
| 144. ALANINE | |||||||||||||
| 145. alanine11 species (cr) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -370.20032000000003 | W | -562.748 | W | |
| 146. alanine12 species (eq, buf) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371 | A | -554.8 | A | |
| 147. alanine13 species (aq) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -370.37 | Ml | -554.8 | A | |
| 148. alanine14 species (aq) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371.54 | T | -554.8 | A->T | |
| 149. alanine15 species | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371.16264 | W | -554.8 | M | |
| 150. alanine16 | |||||||||||||
| 150b. alanine21b cation | 3 | 8 | 1 | 2 | 0 | 0 | 0 | 1 | -384.55144 | W | -554.7984 | W | |
| 151. alanine21 dipolar ion | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371.16264 | W | -554.7984 | W | |
| 152. alanine22 anion | 3 | 6 | 1 | 2 | 0 | 0 | 0 | -1 | -314.846 | W | -509.6112 | W | |
| 153. alanine23 blend (of 151 and 152 only) (H, W) | 3 | ? | 1 | 2 | 0 | 0 | 0 | - | W | - | W | ||
| 154. alanine24 species (eq.buf) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371.16264 | W | -554.7984 | W | |
| 155. alanine25 cation | 3 | 8 | 1 | 2 | 0 | 0 | 0 | 1 | -382.2 | E | -557.9364 | E<W | |
| 156. alanine26: DL-alanine26 (cr) | 3 | 7 | 1 | 2 | 0 | 0 | 0 | 0 | -371.9576 | W | -563.5848 | W | |
| 157. ALLANTOIN | |||||||||||||
| 158. allantoin | 4 | 6 | 4 | 3 | 0 | 0 | 0 | 0 | -446.098 | T | -717.556 | P | |
| 159. ALPHAKETOGLUTARATE | |||||||||||||
| 160. alphaketoglutarate | |||||||||||||
| 161. alphaketoglutarate11: 2- species | 5 | 4 | 0 | 5 | 0 | 0 | 0 | -2 | -793.41 | A | -1044.06 | A | |
| 162. alphaketoglutarate12: 2- species | 5 | 4 | 0 | 5 | 0 | 0 | 0 | -2 | -798.0561600000001 | B | -1044.06 | <-A | |
| 163. alphaketoglutarate21: 2- species | 5 | 4 | 0 | 5 | 0 | 0 | 0 | -2 | -799.7 | M3 | -1044.06 | <-A | |
| 164. alphaketoglutarate22: 1- species | 5 | 5 | 0 | 5 | 0 | 0 | 0 | -1 | -812.6 | M3 | -1044.06 | X | |
| 165. alphaketoglutarate23: neutral species (aq) | 5 | 6 | 0 | 5 | 0 | 0 | 0 | 0 | -840 | M3 | -1026.2 | <-M | |
| 166. alphaketoglutarate24: blend | 5 | ? | 0 | 5 | 0 | 0 | 0 | - | M3 | - | <-M | ||
| 167. alphaketoglutarate30 | |||||||||||||
| 168. alphaketoglutarate31: neutral species (aq) | 5 | 6 | 0 | 5 | 0 | 0 | 0 | 0 | -828.3 | E | -1026.2 | <-M | |
| 169. AMINOETHANESULPHONATE (see taurine; entries 1625 - 1628) | |||||||||||||
| 170. taurine = 2-aminoethanesulphonate NH3+-CH2-CH2-SO3- | 2 | 7 | 1 | 3 | 0 | 1 | 0 | -1 | -509.4 | T | -636.75 | XX Htr | |
| 171. AMMONIA/AMMONIUM | |||||||||||||
| 172. ammonia11: NH3 ammonia-species (aq) | 0 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | -26.5 | A | -80.29 | AWZ | |
| 173. ammonia12: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.31 | A | -132.51 | A | |
| 174. ammonia13: ammonium blend (H, A) | 0 | ? | 1 | 0 | 0 | 0 | 0 | ? | - | A | - | A | |
| 175. ammonia14 | |||||||||||||
| 176. ammonia21: NH3 ammonia-species (aq) | 0 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | -26.5684 | W | -80.29 | W | |
| 177. ammonia22: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.37048 | W | -132.50728 | W | |
| 178. ammonia23: ammonia-blend (W,Z) | 0 | ? | 1 | 0 | 0 | 0 | 0 | ? | - | W | - | W | |
| 179. ammonia24 | |||||||||||||
| 180. ammonia31: NH3 ammonia-species (aq) | 0 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | -26.5 | Z | -80.29 | <-W | |
| 181. ammonia32: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.31 | Z | -132.51 | <-W | |
| 182. ammonia33: ammonium blend (H,Z) | 0 | ? | 1 | 0 | 0 | 0 | 0 | ? | - | Z | - | <-W | |
| 183. ammonia34 | |||||||||||||
| 184. ammonia41: NH3 ammonia-species (aq) | 0 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | -26.57 | T | -80.29 | A->T | |
| 185. ammonia42: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.37 | T | -132.51 | A->T | |
| 186. ammonia43: ammonia-blend | 0 | ? | 1 | 0 | 0 | 0 | 0 | ? | - | T | - | A->T | |
| 187. ammonia44 | |||||||||||||
| 188. ammonia51: NH3 ammonia-species (aq) | 0 | 3 | 1 | 0 | 0 | 0 | 0 | 0 | -26.66 | M0 | -80.29 | A->T | |
| 189. ammonia52: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.46 | M0 | -132.51 | A->T | |
| 190. ammonia53: ammonia-blend | 0 | ? | 1 | 0 | 0 | 0 | 0 | ? | - | - | A->T | ||
| 191. ammonia54 | |||||||||||||
| 192. ammonia61: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -79.397860825 | C | -133.26 | C | |
| 193. ammonia62: NH4+ ammonium -species (aq) | 0 | 4 | 1 | 0 | 0 | 0 | 0 | 1 | -81.9 | E | -133.26 | E<C |
