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Products Information

7-methyl-Quinoline
7-methyl-Quinoline ID: B187342
CAS:612-60-2
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:c12ncccc2ccc(c1)C	
FORMULA: C10H9N
MASS: 143.1852
EXACT MASS: 143.0734993
INTERATOMIC DISTANCES

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

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



ATOMIC CHARGES
   C   1    0.0809926352
   N   2   -0.2438480056
   C   3    0.0148430169
   C   4    0.0176798052
   C   5    0.0011745780
   C   6   -0.0203548199
   C   7   -0.0041593161
   C   8    0.0988263278
   C   9    0.0030896958
   C  10    0.0310769632
   C  11    0.0206791195


BOND ANGLES
   2    1    3  Nar  Car  Car    119.611
   2    1    4  Nar  Car  Car    120.321
   3    1    4  Car  Car  Car    120.069
   1    2    8  Car  Nar  Car    120.113
   1    3    6  Car  Car  Car    119.863
   1    4    5  Car  Car  Car    120.069
   1    4    9  Car  Car  Car    119.782
   5    4    9  Car  Car  Car    120.150
   4    5    7  Car  Car  Car    119.863
   3    6   10  Car  Car   C3    119.863
   3    6    7  Car  Car  Car    120.069
   7    6   10  Car  Car   C3    120.069
   5    7    6  Car  Car  Car    120.069
   2    8   11  Nar  Car  Car    120.137
   4    9   11  Car  Car  Car    119.897
   8   11    9  Car  Car  Car    119.750


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