SMILES:n1(ncc2c1ccc(c2)N)Cc1ccc(F)cc1	

FORMULA: C14H12FN3
MASS: 241.2636
EXACT MASS: 241.1015256
INTERATOMIC DISTANCES

              N   1      N   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   N   2    0.5300     0.0000 
   C   3    0.7668     0.7913     0.0000 
   C   4    0.4731     0.8159     0.4750     0.0000 
   C   5    0.7667     0.4659     0.4730     0.7667     0.0000 
   C   6    0.5166     0.9934     1.2233     0.8009     1.2833     0.0000 
   C   7    0.8627     1.2819     0.8176     0.4703     1.2109     0.9596 
   C   8    1.2109     1.2509     0.4703     0.8176     0.8627     1.6173 
   C   9    1.4107     1.5955     0.8167     0.9448     1.2751     1.7025 
   C  10    0.8635     1.2131     1.6218     1.2321     1.5940     0.4459 
   C  11    1.2751     1.6078     0.9448     0.8167     1.4106     1.4295 
   C  12    1.6662     1.8410     2.4296     2.0908     2.2910     1.3316 
   N  13    1.8840     2.0415     1.2511     1.4187     1.6815     2.1677 
   F  14    2.1186     2.2494     2.8770     2.5517     2.7089     1.7976 
   C  15    0.9275     1.0734     1.6765     1.3827     1.5201     0.7389 
   C  16    1.2791     1.6545     2.0172     1.5929     2.0270     0.7957 
   C  17    1.6268     1.9216     2.3872     1.9892     2.3362     1.1896 
   C  18    1.3708     1.4537     2.1101     1.8287     1.9152     1.1562 

              C   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    0.9417     0.0000 
   C   9    0.8177     0.4703     0.0000 
   C  10    1.4001     2.0409     2.1473     0.0000 
   C  11    0.4704     0.8176     0.4750     1.8704     0.0000 
   C  12    2.2884     2.8764     3.0237     0.8883     2.7588     0.0000 
   N  13    1.2493     0.8209     0.4739     2.6134     0.8197     3.4934 
   F  14    2.7541     3.3295     3.4875     1.3541     3.2245     0.4660 
   C  15    1.6650     2.1339     2.3275     0.4445     2.1257     0.7710 
   C  16    1.6654     2.4105     2.4596     0.4416     2.1255     0.7708 
   C  17    2.0983     2.8028     2.8819     0.7654     2.5620     0.4460 
   C  18    2.1018     2.5719     2.7734     0.7708     2.5659     0.4458 

              N  13      F  14      C  15      C  16      C  17      C  18
              ------------------------------------------------------------------
   N  13    0.0000 
   F  14    3.9579     0.0000 
   C  15    2.8013     1.2026     0.0000 
   C  16    2.9112     1.1922     0.7689     0.0000 
   C  17    3.3391     0.7837     0.8875     0.4424     0.0000 
   C  18    3.2473     0.7969     0.4460     0.8904     0.7711     0.0000 




ATOMIC CHARGES
   N   1   -0.2463602864
   N   2   -0.1673925204
   C   3    0.0395180143
   C   4    0.0798396133
   C   5    0.1216281115
   C   6    0.1537790769
   C   7    0.0201768973
   C   8    0.0211486103
   C   9    0.0892388987
   C  10    0.0022472889
   C  11    0.0195887605
   C  12    0.1401254164
   N  13   -0.1280553620
   F  14   -0.2041720932
   C  15   -0.0000313205
   C  16   -0.0000313205
   C  17    0.0293761075
   C  18    0.0293761075


BOND ANGLES
   5    3    4  Car  Car  Car    107.952
   3    4    1  Car  Car  Nar    107.964
   8    9   11  Car  Car  Car    119.737
   9   11    7  Car  Car  Car    119.748
  17   12   18  Car  Car  Car    119.686
  12   18   15  Car  Car  Car    119.675
   4    3    5  Car  Car  Car    107.952
   3    5    2  Car  Car  Nar    114.873
  18   12   17  Car  Car  Car    119.686
  12   17   16  Car  Car  Car    120.359
  11    9    8  Car  Car  Car    119.737
   9    8    3  Car  Car  Car    120.519


TORSION ANGLES
   5    2    1    4      0.026
   5    2    1    6    179.974
   8    3    4    1    179.974
   8    3    4    7      0.026
   5    3    4    1      0.026
   5    3    4    7    179.974
   3    4    1    2      0.026
   3    4    1    6    179.974
   7    4    1    2    179.974
   7    4    1    6      0.026
   3    5    2    1      0.026
  10    6    1    2      0.026
  10    6    1    4    179.974
  11    7    4    3      0.026
  11    7    4    1    179.974
   9    8    3    4      0.026
   9    8    3    5    179.974
  13    9   11    7    179.974
   8    9   11    7      0.026
  15   10    6    1      0.026
  16   10    6    1    179.974
   9   11    7    4      0.026
  14   12   18   15    179.974
  17   12   18   15      0.026
  18   15   10    6    179.974
  18   15   10   16      0.026
  17   16   10    6    179.974
  17   16   10   15      0.026
  12   17   16   10      0.026
  12   18   15   10      0.026
   4    3    5    2      0.026
   8    3    5    2    179.974
  18   12   17   16      0.026
  14   12   17   16    179.974
  11    9    8    3      0.026
  13    9    8    3    179.974


CHIRAL ATOMS
   N     1 is chiral: counterclockwise