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3-Bromo-2-fluoropyridine
3-Bromo-2-fluoropyridine ID: B184535
CAS:36178-05-9
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:c1(ncccc1Br)F	
FORMULA: C5H3BrFN
MASS: 175.9864
EXACT MASS: 174.9432893
INTERATOMIC DISTANCES

              C   1      N   2      C   3      F   4     Br   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    0.7432     0.0000 
   C   3    0.7417     1.2879     0.0000 
   F   4    0.7504     1.2917     1.2921     0.0000 
  Br   5    1.2900     1.9705     0.7468     1.4917     0.0000 
   C   6    1.2875     0.7468     1.4859     1.9735     2.2326     0.0000 
   C   7    1.2843     1.4875     0.7411     1.9701     1.2875     1.2864 
   C   8    1.4859     1.2900     1.2875     2.2363     1.9693     0.7417 

              C   7      C   8
              ----------------------
   C   7    0.0000 
   C   8    0.7447     0.0000 



ATOMIC CHARGES
   C   1    0.2284743976
   N   2   -0.2160416465
   C   3    0.0804514975
   F   4   -0.1826703676
  Br   5   -0.0450128550
   C   6    0.1013205193
   C   7    0.0121386420
   C   8    0.0213398125


BOND ANGLES
   2    1    3  Nar  Car  Car    120.301
   2    1    4  Nar  Car    F    119.717
   3    1    4  Car  Car    F    119.982
   1    2    6  Car  Nar  Car    119.556
   1    3    5  Car  Car   Br    120.143
   1    3    7  Car  Car  Car    120.021
   5    3    7   Br  Car  Car    119.836
   2    6    8  Nar  Car  Car    120.143
   3    7    8  Car  Car  Car    120.116
   6    8    7  Car  Car  Car    119.863


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