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di-n-butyl sulfone   2154 Di-n-butyl sulfone

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    #  Species Formula
  2144 Diethyl sulfoneC4H10O2S
  2145 Methyl-i-propyl sulfoneC4H10O2S
  2146 Methyl n-butyl sulfoneC5H12O2S
  2147 Methyl-t-butyl sulfoneC5H12O2S
  2148 Di-n-propyl sulfoneC6H14O2S
  2149 Ethyl-t-butyl sulfoneC6H14O2S
  2150 Diethoxy ethylthiomethaneC7H16O2S
  2151 Benzyl methyl sulfoneC8H10O2S
  2152 p-Tolyl methyl sulfoneC8H10O2S
  2153 Di-i-butyl sulfoneC8H18O2S
  2154 Di-n-butyl sulfone C8H18O2S
  2155 Di-tert-butyl sulfoneC8H18O2S
  2156 Diisobutyl sulfoneC8H18O2S
  2157 (E)-1-Methyl-4-(1-propenyl-sulfonyl)-benzeneC10H12O2S
  2158 1-Methyl-4-(1-methyl-ethenylsulfonyl) benzeneC10H12O2S
  2159 2-Butenyl p-tolyl sulfoneC11H14O2S
  2160 2-Methyl-2-propenyl p-tolyl sulfoneC11H14O2S
  2161 3-Butenyl p-tolyl sulfoneC11H14O2S
  2162 Diphenyl sulfoneC12H10O2S
  2163 CysteineC3H7NO2S
  2164 MethionineC5H11NO2S


ΔHf: -122.2 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Di-n-butyl sulfone
 H=-122.2 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.53706042 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.53013163 +1  110.5139054 +1    0.0000000 +0     2     1     0
  S     1.80070760 +1  111.2528816 +1  179.9903604 +1     3     2     1
  C     1.80044236 +1  103.6895091 +1 -179.5689226 +1     4     3     2
  C     1.53118795 +1  110.9440078 +1  179.8571984 +1     5     4     3
  C     1.53668724 +1  110.4897669 +1  179.9461552 +1     6     5     4
  O     1.44778679 +1  107.8152637 +1  114.1611143 +1     4     3     5
  O     1.44771949 +1  107.8169957 +1  131.6921286 +1     4     3     8
  H     1.10603354 +1  110.1354831 +1  -58.6357827 +1     1     2     3
  H     1.10594873 +1  110.1566442 +1  116.5786607 +1     1     2    10
  C     1.52826013 +1  110.6351189 +1  121.7216753 +1     1     2    11
  H     1.11071544 +1  109.3998508 +1  122.3323144 +1     2     1     3
  H     1.11079432 +1  109.3726439 +1  115.3886181 +1     2     1    13
  H     1.10549056 +1  109.5193678 +1  121.8522516 +1     3     2     4
  H     1.10566604 +1  109.4441515 +1  116.2389133 +1     3     2    15
  H     1.10525625 +1  110.1393920 +1  121.3282398 +1     5     4     6
  H     1.10500854 +1  110.2076056 +1  117.2189923 +1     5     4    17
  H     1.11070782 +1  110.8233782 +1  121.4950945 +1     6     5     7
  H     1.11078483 +1  110.8043827 +1  117.0755345 +1     6     5    19
  H     1.10613413 +1  110.1463217 +1  -58.6012744 +1     7     6     5
  H     1.10600999 +1  110.1903780 +1  116.5858600 +1     7     6    21
  C     1.52841603 +1  110.6267689 +1  121.7290867 +1     7     6    22
  H     1.09627512 +1  111.5235580 +1  -60.3247584 +1    12     1     2
  H     1.09627019 +1  111.5403994 +1  120.1561823 +1    12     1    24
  H     1.09547694 +1  111.3295988 +1  119.9251582 +1    12     1    25
  H     1.09627610 +1  111.5127024 +1   60.0830809 +1    23     7     6
  H     1.09629331 +1  111.5234890 +1 -120.1384571 +1    23     7    27
  H     1.09544578 +1  111.3420203 +1 -119.9289640 +1    23     7    28