Accuracy

vinylacetr     48 Vinylacetylene (Geo)

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    #  Species Formula
    38 PropeneC3H6
    39 Propene (Geo)C3H6
    40 i-Propyl radicalC3H7
    41 PropaneC3H8
    42 Propane (Geo)C3H8
    43 Carbon, tetramerC4
    44 Diacetylene (Geo)C4H2
    45 DiacetyleneC4H2
    46 CH2=C=C=CH2 (Geo)C4H4
    47 CH2=C=C=CH2C4H4
    48 Vinylacetylene (Geo) C4H4
    49 VinylacetyleneC4H4
    50 1-ButyneC4H6
    51 1,2-ButadieneC4H6
    52 2-ButyneC4H6
    53 1,3-ButadieneC4H6
    54 Bicyclobutane (Geo)C4H6
    55 BicyclobutaneC4H6
    56 2-Butyne (Geo)C4H6
    57 CyclobuteneC4H6
    58 Methyl cyclopropeneC4H6


REF: T. Fukuyama, K. Kuchitsu, Y. Morino, Bull. Chem. Soc. Jap., 42, 379 (1969).
  

Vinylacetylene
 GR=FKM1969 <C3-C4> <C2-C3> <C2-C3-C4> <C1-C2>
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.34100000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.43100000 +1  123.1000000 +1    0.0000000 +0     2     1     0
 XX     1.00000000 +0   90.0000000 +0  180.0000000 +0     3     2     1
  C     1.20800000 +1   90.0000000 +0  180.0000000 +0     3     4     2
 XX     1.00000000 +0   90.0000000 +0    0.0000000 +0     5     3     4
  H     1.02799533 +1   90.0000000 +0  180.0000000 +0     5     6     3
  H     1.08024685 +1  123.6096754 +1    0.0000000 +0     1     2     3
  H     1.07965618 +1  123.2130063 +1  180.0000000 +0     1     2     3
  H     1.09708912 +1  121.9460899 +1  180.0000000 +0     2     1     3