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2-Amino-4,6-dichlorotriazine
2-Amino-4,6-dichlorotriazine ID: API-42898
CAS:933-20-0
Supplier:APIchem

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SMILES:Clc1nc(nc(Cl)n1)N	ChemMol.com
FORMULA: C3H2Cl2N4
MASS: 164.9808
EXACT MASS: 163.9656514
INTERATOMIC DISTANCES

             Cl   1     Cl   2      N   3      N   4      N   5      N   6
              ------------------------------------------------------------------
  Cl   1    0.0000 
  Cl   2    3.4641     0.0000 
   N   3    3.0000     1.7320     0.0000 
   N   4    1.7320     2.9999     1.7320     0.0000 
   N   5    1.7320     1.7320     1.7320     1.7320     0.0000 
   N   6    3.4641     3.4641     1.7321     1.7321     3.0000     0.0000 
   C   7    2.6457     2.6457     1.0000     1.0000     2.0000     1.0001 
   C   8    1.0000     2.6457     2.0000     1.0000     1.0000     2.6458 
   C   9    2.6457     1.0000     1.0000     2.0000     1.0000     2.6458 
   H  10    3.5192     4.0130     2.2901     1.8397     3.3533     0.6200 
   H  11    4.0131     3.5191     1.8397     2.2901     3.3533     0.6200 

              C   7      C   8      C   9      H  10      H  11
              -------------------------------------------------------
   C   7    0.0000 
   C   8    1.7320     0.0000 
   C   9    1.7320     1.7320     0.0000 
   H  10    1.4158     2.8292     3.1408     0.0000 
   H  11    1.4158     3.1408     2.8292     1.0739     0.0000 



ATOMIC CHARGES
  Cl   1   -0.0408847452
  Cl   2   -0.0408847452
   N   3   -0.1842333327
   N   4   -0.1842333327
   N   5   -0.1870312575
   N   6   -0.3273365702
   C   7    0.2177801975
   C   8    0.2282560015
   C   9    0.2282560015
   H  10    0.1451558915
   H  11    0.1451558915


BOND ANGLES
   7    3    9  Car  Nar  Car    119.999
   7    4    8  Car  Nar  Car    120.001
   8    5    9  Car  Nar  Car    120.001
   7    6   10  Car  Npl   HC    120.000
   7    6   11  Car  Npl   HC    119.998
  10    6   11   HC  Npl   HC    120.002
   3    7    4  Nar  Car  Nar    120.001
   3    7    6  Nar  Car  Npl    120.001
   4    7    6  Nar  Car  Npl    119.998
   1    8    4   Cl  Car  Nar    120.001
   1    8    5   Cl  Car  Nar    120.001
   4    8    5  Nar  Car  Nar    119.999
   2    9    3   Cl  Car  Nar    119.999
   2    9    5   Cl  Car  Nar    120.001
   3    9    5  Nar  Car  Nar    120.001


TORSION ANGLES
   9    3    7    4      0.026
   9    3    7    6    179.974
   7    3    9    2    179.974
   7    3    9    5      0.026
   8    4    7    3      0.026
   8    4    7    6    179.974
   7    4    8    1    179.974
   7    4    8    5      0.026
   9    5    8    1    179.974
   9    5    8    4      0.026
   8    5    9    2    179.974
   8    5    9    3      0.026
  10    6    7    3    179.974
  10    6    7    4      0.026
  11    6    7    3      0.026
  11    6    7    4    179.974