Minima for acetylcarnitine in water by AM1/COSMO
A B C D E δHf μ F % Cont. δHf Cont. μ
g- g- a g- s -191.8 26.67 0.41 40.73 -78.11 11.22
g- a a a s -191.7 29.90 0.37 37.43 -71.77 10.62
g+ a g+ a s -190.8 28.67 0.07 7.40 -14.11 2.23
a a g+ s s -190.6 26.35 0.06 5.74 -10.95 1.46
g- g+ a g- s -190 24.93 0.02 1.88 -3.58 0.50
g- a g- a s -190 28.34 0.02 1.88 -3.58 0.57
g- g- g- g- s -189.9 25.42 0.02 1.62 -3.07 0.43
a a g- a s -189.7 26.52 0.01 1.14 -2.15 0.32
g- g- g- a s -189.2 25.65 0.01 0.54 -1.02 0.13
a g- g+ g- s -189.2 22.03 0.01 0.50 -0.95 0.12
g+ g- a g- s -188.9 23.99 0.00 0.34 0.64 0.08
a g- g+ a s -188.9 21.55 0.00 0.31 -0.59 0.07
g- g- g- a s -188.7 24.92 0.00 0.24 -0.45 0.06
a g+ a g- s -188.4 24.57 0.00 0.13 -0.24 0.03
g- g- a a a -188.3 21.55 0.00 0.12 -0.22 0.02
-191.44 27.86