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232 Styrene

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  #           Species Formula
  222 2,2-Dimethyl pentaneC7H16
  223 2,3-Dimethyl pentaneC7H16
  224 2,4-Dimethyl pentaneC7H16
  225 2-Methyl hexaneC7H16
  226 3,3-Dimethyl pentaneC7H16
  227 3-Ethyl pentaneC7H16
  228 3-Methyl hexaneC7H16
  229 n-HeptaneC7H16
  230 CubaneC8H8
  231 CyclooctatetraeneC8H8
  232 Styrene C8H8
  233 EthylbenzeneC8H10
  234 m-XyleneC8H10
  235 o-XyleneC8H10
  236 p-XyleneC8H10
  237 1,5-CyclooctadieneC8H12
  238 4-Vinyl cyclohexeneC8H12
  239 1-OctyneC8H14
  240 2,5-Dimethyl 2,4-hexadieneC8H14
  241 2-OctyneC8H14
  242 3,4-Dimethyl-(E,E)-2,4-hexadieneC8H14



DHf: 35.3 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.

  
 SYMMETRY
Styrene
 H=35.3,0.25 HR=C&P1970
  C         0.00000000 +0    0.0000000 +0    0.0000000 +0                      0.0000
  C         2.81384892 +1    0.0000000 +0    0.0000000 +0    1    0    0       0.0000
 XX         1.00000000 +0   90.0000000 +0    0.0000000 +0    2    1    0
 XX         1.00000000 +0   90.0000000 +0    0.0000000 +0    1    2    3
  C         1.39855636 +1   59.8552659 +1    0.0000000 +0    1    2    3       0.0000
  C         1.39855636 +0   59.8552659 +0  180.0000000 +0    1    2    3       0.0000
  C         1.40677624 +1   59.4500821 +1    0.0000000 +0    2    1    4       0.0000
  C         1.40677624 +0   59.4500821 +0  180.0000000 +0    2    1    4       0.0000
  H         1.08762108 +1   90.0000000 +0  180.0000000 +0    1    4    2       0.0000
  H         1.08900926 +1  119.9196277 +1  180.0000000 +0    5    1    2       0.0000
  H         1.08900926 +0  119.9196277 +0  180.0000000 +0    6    1    2       0.0000
  H         1.08912645 +1  119.9302626 +1  180.0000000 +0    7    2    1       0.0000
  H         1.08912645 +0  119.9302626 +0  180.0000000 +0    8    2    1       0.0000
  C         1.47236952 +1   91.5231443 +1  179.9938037 +1    2    3    1       0.0000
  C         1.33430090 +1  125.2158205 +1    0.6384095 +1   14    2    3       0.0000
  H         1.09518200 +1  114.6282597 +1 -179.3838431 +1   14    2    3       0.0000
  H         1.08072319 +1  122.8604254 +1  179.9900839 +1   15   14    2       0.0000
  H         1.08063647 +1  124.1659201 +1    0.0032407 +1   15   14    2       0.0000