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3-bromo-2-chloropyridin-4-amine
3-bromo-2-chloropyridin-4-amine
ID: BP-11811
CAS:215364-85-5
Supplier:BroadPharm

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SMILES:c1(c(nccc1N)Cl)Br	
FORMULA: C5H4BrClN2
MASS: 207.4557
EXACT MASS: 205.9246378
INTERATOMIC DISTANCES

              C   1      C   2      N   3      C   4     Br   5     Cl   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.6000     0.0000 
   N   3    1.0398     0.6010     0.0000 
   C   4    0.6010     1.0398     1.2000     0.0000 
  Br   5    0.5975     1.0378     1.5863     1.0375     0.0000 
  Cl   6    1.0341     0.5954     1.0375     1.5831     1.1958     0.0000 
   N   7    1.0398     1.5878     1.8000     0.6000     1.1985     2.0740 
   C   8    1.1985     1.0375     0.5975     1.0378     1.7960     1.5821 
   C   9    1.0375     1.1985     1.0378     0.5975     1.5829     1.7939 

              N   7      C   8      C   9
              ---------------------------------
   N   7    0.0000 
   C   8    1.5865     0.0000 
   C   9    1.0378     0.6000     0.0000 



ATOMIC CHARGES
   C   1    0.0796921684
   C   2    0.1457785278
   N   3   -0.2318417781
   C   4    0.0991102216
  Br   5   -0.0451149554
  Cl   6   -0.0607655763
   N   7   -0.1274107951
   C   8    0.1012637274
   C   9    0.0392884598


BOND ANGLES
   2    1    4  Car  Car  Car    119.944
   2    1    5  Car  Car   Br    120.140
   4    1    5  Car  Car   Br    119.917
   1    2    3  Car  Car  Nar    119.944
   1    2    6  Car  Car   Cl    119.790
   3    2    6  Nar  Car   Cl    120.266
   2    3    8  Car  Nar  Car    119.917
   1    4    7  Car  Car  Npl    119.944
   1    4    9  Car  Car  Car    119.917
   7    4    9  Npl  Car  Car    120.140
   3    8    9  Nar  Car  Car    120.140
   4    9    8  Car  Car  Car    120.140


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