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2-Fluoro-6-methylaniline
2-Fluoro-6-methylaniline ID: API-39745
CAS:443-89-0
Supplier:APIchem

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SMILES:Fc1c(N)c(ccc1)C	ChemMol.com
FORMULA: C7H8FN
MASS: 125.1435
EXACT MASS: 125.0640775
INTERATOMIC DISTANCES

              F   1      N   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   F   1    0.0000 
   N   2    2.0000     0.0000 
   C   3    2.6458     1.7320     0.0000 
   C   4    1.7321     1.0000     1.0000     0.0000 
   C   5    3.0000     2.6457     1.0000     1.7320     0.0000 
   C   6    1.0000     1.7321     1.7321     1.0001     2.0000     0.0000 
   C   7    3.4641     2.0000     1.0000     1.7320     1.7320     2.6458 
   C   8    2.6458     3.0000     1.7320     2.0000     1.0000     1.7321 
   C   9    1.7320     2.6458     2.0000     1.7321     1.7321     1.0000 
   H  10    3.6200     3.1407     1.4158     2.2900     0.6200     2.6200 
   H  11    3.1995     1.4955     1.1766     1.5200     2.1114     2.5121 
   H  12    4.0130     2.3715     1.6199     2.2900     2.2900     3.2380 
   H  13    3.8121     2.5557     1.1766     2.1114     1.5200     2.9083 
   H  14    3.1408     3.6200     2.2901     2.6200     1.4158     2.2901 
   H  15    1.8397     3.1408     2.6200     2.2901     2.2901     1.4158 
   H  16    1.7732     0.6201     2.2901     1.4158     3.1408     1.8397 
   H  17    2.6200     0.6200     1.8397     1.4158     2.8292     2.2901 

              C   7      C   8      C   9      H  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    2.6457     0.0000 
   C   9    3.0000     1.0001     0.0000 
   H  10    1.8397     1.4157     2.2901     0.0000 
   H  11    0.6200     2.9083     3.0634     2.3470     0.0000 
   H  12    0.6200     3.2379     3.6200     2.2901     0.8768     0.0000 
   H  13    0.6200     2.5121     3.0634     1.4245     1.2399     0.8768 
   H  14    3.1407     0.6200     1.4158     1.6199     3.4624     3.7058 
   H  15    3.6200     1.4158     0.6200     2.8059     3.6727     4.2400 
   H  16    2.6200     3.3533     2.8292     3.6739     2.1060     2.9788 
   H  17    1.7732     3.3533     3.1408     3.2380     1.1752     2.0000 

              H  13      H  14      H  15      H  16      H  17
              -------------------------------------------------------
   H  13    0.0000 
   H  14    2.9170     0.0000 
   H  15    3.6727     1.6200     0.0000 
   H  16    3.1721     3.9665     3.2380     0.0000 
   H  17    2.3825     3.9665     3.6739     1.0739     0.0000 



ATOMIC CHARGES
   F   1   -0.2035530805
   N   2   -0.3555472054
   C   3   -0.0270134474
   C   4    0.0631795640
   C   5   -0.0569243426
   C   6    0.1441667393
   C   7   -0.0378810811
   C   8   -0.0586821830
   C   9   -0.0246029217
   H  10    0.0620793607
   H  11    0.0278119118
   H  12    0.0278119118
   H  13    0.0278119118
   H  14    0.0618535990
   H  15    0.0646719914
   H  16    0.1424086359
   H  17    0.1424086359


BOND ANGLES
   4    2   16  Car  Npl   HC    119.997
   4    2   17  Car  Npl   HC    120.002
  16    2   17   HC  Npl   HC    120.001
   4    3    5  Car  Car  Car    120.001
   4    3    7  Car  Car   C3    119.999
   5    3    7  Car  Car   C3    120.001
   2    4    3  Npl  Car  Car    120.001
   2    4    6  Npl  Car  Car    119.998
   3    4    6  Car  Car  Car    120.001
   3    5    8  Car  Car  Car    120.001
   3    5   10  Car  Car   HC    120.002
   8    5   10  Car  Car   HC    119.998
   1    6    4    F  Car  Car    120.001
   1    6    9    F  Car  Car    120.001
   4    6    9  Car  Car  Car    119.998
   3    7   11  Car   C3   HC     89.999
   3    7   12  Car   C3   HC    179.974
   3    7   13  Car   C3   HC     90.001
  11    7   12   HC   C3   HC     90.000
  11    7   13   HC   C3   HC    179.974
  12    7   13   HC   C3   HC     90.000
   5    8    9  Car  Car  Car    120.001
   5    8   14  Car  Car   HC    120.001
   9    8   14  Car  Car   HC    119.998
   6    9    8  Car  Car  Car    119.998
   6    9   15  Car  Car   HC    120.002
   8    9   15  Car  Car   HC    120.000


TORSION ANGLES
  16    2    4    3    179.974
  16    2    4    6      0.026
  17    2    4    3      0.026
  17    2    4    6    179.974
   5    3    4    2    179.974
   5    3    4    6      0.026
   7    3    4    2      0.026
   7    3    4    6    179.974
   4    3    5    8      0.026
   4    3    5   10    179.974
   7    3    5    8    179.974
   7    3    5   10      0.026
   4    3    7   11      0.026
   4    3    7   12      0.026
   4    3    7   13    179.974
   5    3    7   11    179.974
   5    3    7   12    179.974
   5    3    7   13      0.026
   2    4    6    1      0.026
   2    4    6    9    179.974
   3    4    6    1    179.974
   3    4    6    9      0.026
   3    5    8    9      0.026
   3    5    8   14    179.974
  10    5    8    9    179.974
  10    5    8   14      0.026
   1    6    9    8    179.974
   1    6    9   15      0.026
   4    6    9    8      0.026
   4    6    9   15    179.974
   5    8    9    6      0.026
   5    8    9   15    179.974
  14    8    9    6    179.974
  14    8    9   15      0.026