Accuracy

(CH3O)(C2H5O)SO   2171 (CH3O)(C2H5O)SO

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    #  Species Formula
  2161 3-Butenyl p-tolyl sulfoneC11H14O2S
  2162 Diphenyl sulfoneC12H10O2S
  2163 CysteineC3H7NO2S
  2164 MethionineC5H11NO2S
  2165 Sulfur trioxide (Geo)O3S
  2166 Sulfur trioxideO3S
  2167 HOSO2(-)HO3S
  2168 H2SO3H2O3S
  2169 Dimethyl sulfiteC2H6O3S
  2170 Dimethyl sulfite (Geo)C2H6O3S
  2171 (CH3O)(C2H5O)SO C3H8O3S
  2172 Diethyl sulfiteC4H10O3S
  2173 Dipropyl sulfiteC6H14O3S
  2174 Di-n-butyl sulfiteC8H18O3S
  2175 Li(I)O3N (FOBHEJ) (Geo)H18LiC10NO3S
  2176 Li(I)O3N (FOBHEJ)H18LiC10NO3S
  2177 Sulfuric acid (Geo)H2O4S
  2178 Sulfuric acidH2O4S
  2179 Lithium sulfate anionLiO4S
  2180 Lithium sulfateLi2O4S
  2181 Dimethyl sulfateC2H6O4S


ΔHf: -125.2 kcal/mol,     REF: P. Winget, A.H.C. Horn, C. Seloki, B. Martin, T. Clark, J. Mol. Model. 9, 408 (2003).
  
 PM7
(CH3O)(C2H5O)SO
 HR=WHSMC03 H=-125.2
  S     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.67413658 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.65194543 +1   99.0222732 +1    0.0000000 +0     1     2     0
  O     1.46203649 +1  104.6868965 +1 -112.4896297 +1     1     2     3
  C     1.40431864 +1  122.5212379 +1  100.4981760 +1     2     1     3
  C     1.40676992 +1  126.5492939 +1  -66.6087902 +1     3     1     2
  C     1.52230762 +1  111.3055047 +1  -72.8662125 +1     6     3     1
 XX     0.95605900 +1  123.2142870 +1   56.4354290 +1     4     1     2
  H     1.09634023 +1  109.5714746 +1  -82.7612804 +1     5     2     1
  H     1.09851841 +1  112.0002530 +1  123.1187058 +1     5     2     9
  H     1.09948881 +1  103.7879828 +1  118.9923487 +1     5     2    10
  H     1.10505832 +1  109.6882112 +1  125.0365816 +1     6     3     7
  H     1.11043952 +1  101.9704919 +1  115.6389733 +1     6     3    12
  H     1.09739378 +1  111.1612890 +1  -51.0562631 +1     7     6     3
  H     1.10066704 +1  111.9567761 +1  118.8842678 +1     7     6    14
  H     1.09426042 +1  111.4835006 +1  120.6755556 +1     7     6    15