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Products Information

7-Quinolinamine
7-Quinolinamine ID: B187353
CAS:580-19-8
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:c12cc(N)ccc2cccn1	
FORMULA: C9H8N2
MASS: 144.1732
EXACT MASS: 144.0687483
INTERATOMIC DISTANCES

              C   1      C   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    0.8233     0.0000 
   N   3    0.8254     1.4250     0.0000 
   C   4    0.8250     1.4280     1.4316     0.0000 
   C   5    1.4250     0.8233     2.1777     1.6466     0.0000 
   C   6    1.4280     1.6500     2.1833     0.8233     1.4280     0.0000 
   N   7    2.1769     1.4250     2.8500     2.4699     0.8233     2.1802 
   C   8    1.6466     1.4280     2.4720     1.4250     0.8250     0.8233 
   C   9    1.4251     2.1746     0.8192     1.6529     2.8500     2.4762 
   C  10    1.4321     2.1856     1.6542     0.8305     2.4771     1.4333 
   C  11    1.6517     2.4750     1.4321     1.4333     2.9738     2.1859 

              N   7      C   8      C   9      C  10      C  11
              -------------------------------------------------------
   N   7    0.0000 
   C   8    1.4280     0.0000 
   C   9    3.5849     2.9705     0.0000 
   C  10    3.3004     2.1851     1.4347     0.0000 
   C  11    3.7778     2.8583     0.8333     0.8254     0.0000 



ATOMIC CHARGES
   C   1    0.0826504438
   C   2    0.0371409603
   N   3   -0.2437941423
   C   4    0.0177856670
   C   5    0.0905913296
   C   6    0.0028805016
   N   7   -0.1280065882
   C   8    0.0181545648
   C   9    0.0988271047
   C  10    0.0030910307
   C  11    0.0206791280


BOND ANGLES
   2    1    3  Car  Car  Nar    119.611
   2    1    4  Car  Car  Car    120.069
   3    1    4  Nar  Car  Car    120.321
   1    2    5  Car  Car  Car    119.863
   1    3    9  Car  Nar  Car    120.113
   1    4    6  Car  Car  Car    120.069
   1    4   10  Car  Car  Car    119.782
   6    4   10  Car  Car  Car    120.150
   2    5    7  Car  Car  Npl    119.863
   2    5    8  Car  Car  Car    120.069
   7    5    8  Npl  Car  Car    120.069
   4    6    8  Car  Car  Car    119.863
   5    8    6  Car  Car  Car    120.069
   3    9   11  Nar  Car  Car    120.137
   4   10   11  Car  Car  Car    119.897
   9   11   10  Car  Car  Car    119.750


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