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2,3-dichloroprop-1-ene
2,3-dichloroprop-1-ene ID: AN-23965
CAS:78-88-6
Supplier:AN PharmaTech Co Ltd

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SMILES:ClCC(=C)Cl	6565
FORMULA: C3H4Cl2
MASS: 110.9699
EXACT MASS: 109.9690055
INTERATOMIC DISTANCES

             Cl   1     Cl   2      C   3      C   4      C   5      H   6
              ------------------------------------------------------------------
  Cl   1    0.0000 
  Cl   2    2.6458     0.0000 
   C   3    1.0001     1.7320     0.0000 
   C   4    1.7321     1.0000     1.0000     0.0000 
   C   5    2.0000     1.7320     1.7320     1.0000     0.0000 
   H   6    1.0813     2.1829     0.6201     1.5968     2.3452     0.0000 
   H   7    1.5968     1.4156     0.6200     1.0813     2.0296     0.7971 
   H   8    2.6200     1.8397     2.2900     1.4158     0.6200     2.9097 
   H   9    1.7732     2.2901     1.8397     1.4158     0.6201     2.3980 

              H   7      H   8      H   9
              ---------------------------------
   H   7    0.0000 
   H   8    2.4960     0.0000 
   H   9    2.2861     1.0739     0.0000 



ATOMIC CHARGES
  Cl   1   -0.1195090519
  Cl   2   -0.0875956437
   C   3    0.0576359517
   C   4    0.0259934021
   C   5   -0.0831956583
   H   6    0.0487042947
   H   7    0.0487042947
   H   8    0.0546312053
   H   9    0.0546312053


BOND ANGLES
   1    3    4   Cl   C3   C2    120.001
   1    3    6   Cl   C3   HC     79.996
   1    3    7   Cl   C3   HC    159.993
   4    3    6   C2   C3   HC    160.003
   4    3    7   C2   C3   HC     80.006
   6    3    7   HC   C3   HC     79.997
   2    4    3   Cl   C2   C3    119.999
   2    4    5   Cl   C2   C2    120.001
   3    4    5   C3   C2   C2    120.001
   4    5    8   C2   C2   HC    120.002
   4    5    9   C2   C2   HC    119.997
   8    5    9   HC   C2   HC    120.001


TORSION ANGLES
   1    3    4    2    179.974
   1    3    4    5      0.026
   6    3    4    2      0.026
   6    3    4    5    179.974
   7    3    4    2      0.026
   7    3    4    5    179.974
   2    4    5    8      0.026
   2    4    5    9    179.974
   3    4    5    8    179.974
   3    4    5    9      0.026