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7-Methylimidazo[1,2-a]pyridine
7-Methylimidazo[1,2-a]pyridine ID: API-42708
CAS:874-39-5
Supplier:APIchem

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SMILES:n12c(ncc2)cc(cc1)C	ChemMol.com
FORMULA: C8H8N2
MASS: 132.1625
EXACT MASS: 132.0687483
INTERATOMIC DISTANCES

              N   1      N   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   N   2    1.6117     0.0000 
   C   3    1.0000     0.9941     0.0000 
   C   4    2.0000     2.6956     1.7321     0.0000 
   C   5    1.7321     1.8228     1.0001     1.0000     0.0000 
   C   6    1.0001     2.5576     1.7321     1.7320     2.0000     0.0000 
   C   7    1.7321     2.9792     2.0000     1.0000     1.7320     1.0000 
   C   8    0.9941     1.6094     1.6117     2.9792     2.5576     1.8228 
   C   9    3.0000     3.5497     2.6458     1.0000     1.7320     2.6457 
   C  10    1.6094     0.9940     1.6094     3.3000     2.5962     2.5962 
   H  11    2.2901     1.9872     1.4158     1.4158     0.6200     2.6200 
   H  12    1.4158     3.0271     2.2901     2.2901     2.6200     0.6200 
   H  13    2.2901     3.5979     2.6200     1.4158     2.2900     1.4157 
   H  14    1.4478     2.2071     2.2100     3.4394     3.1226     2.0432 
   H  15    3.0634     3.8694     2.9083     1.1766     2.1114     2.5121 
   H  16    3.6200     4.1124     3.2380     1.6199     2.2900     3.2379 
   H  17    3.0634     3.3161     2.5121     1.1766     1.5200     2.9083 
   H  18    2.2072     1.4478     2.2072     3.9140     3.1774     3.1774 

              C   7      C   8      C   9      C  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    2.6956     0.0000 
   C   9    1.7320     3.9773     0.0000 
   C  10    3.3000     0.9940     4.2473     0.0000 
   H  11    2.2901     3.0271     1.8396     2.8922     0.0000 
   H  12    1.4158     1.9872     3.1407     2.8922     3.2400     0.0000 
   H  13    0.6200     3.2152     1.8397     3.8842     2.8059     1.6199 
   H  14    3.0069     0.6200     4.4380     1.4478     3.6199     2.0176 
   H  15    1.5200     4.0575     0.6200     4.4620     2.3470     2.9170 
   H  16    2.2900     4.5965     0.6200     4.8453     2.2900     3.7058 
   H  17    2.1114     3.9930     0.6200     4.1156     1.4244     3.4624 
   H  18    3.9140     1.4478     4.8521     0.6200     3.4235     3.4235 

              H  13      H  14      H  15      H  16      H  17      H  18
              ------------------------------------------------------------------
   H  13    0.0000 
   H  14    3.4575     0.0000 
   H  15    1.4245     4.4527     0.0000 
   H  16    2.2901     5.0574     0.8768     0.0000 
   H  17    2.3470     4.5093     1.2399     0.8768     0.0000 
   H  18    4.4924     1.7220     5.0791     5.4447     4.6965     0.0000 




ATOMIC CHARGES
   N   1   -0.3065901651
   N   2   -0.2361166701
   C   3    0.1377356195
   C   4   -0.0456121624
   C   5   -0.0158885379
   C   6    0.0114199624
   C   7   -0.0421451452
   C   8    0.0292508998
   C   9   -0.0395495386
   C  10    0.0464035904
   H  11    0.0656724243
   H  12    0.0813181999
   H  13    0.0634764514
   H  14    0.0828526968
   H  15    0.0277552548
   H  16    0.0277552548
   H  17    0.0277552548
   H  18    0.0845066103


BOND ANGLES
   3    1    6  Car  Nar  Car    119.998
   3    1    8  Car  Nar  Car    107.850
   6    1    8  Car  Nar  Car    132.152
   3    2   10  Car  Nar  Car    108.101
   1    3    2  Nar  Car  Nar    107.850
   1    3    5  Nar  Car  Car    119.998
   2    3    5  Nar  Car  Car    132.152
   5    4    7  Car  Car  Car    120.001
   5    4    9  Car  Car   C3    119.999
   7    4    9  Car  Car   C3    120.001
   3    5    4  Car  Car  Car    120.001
   3    5   11  Car  Car   HC    119.998
   4    5   11  Car  Car   HC    120.001
   1    6    7  Nar  Car  Car    120.001
   1    6   12  Nar  Car   HC    119.998
   7    6   12  Car  Car   HC    120.001
   4    7    6  Car  Car  Car    120.001
   4    7   13  Car  Car   HC    120.002
   6    7   13  Car  Car   HC    119.998
   1    8   10  Nar  Car  Car    108.101
   1    8   14  Nar  Car   HC    125.949
  10    8   14  Car  Car   HC    125.950
   4    9   15  Car   C3   HC     90.001
   4    9   16  Car   C3   HC    179.974
   4    9   17  Car   C3   HC     89.999
  15    9   16   HC   C3   HC     90.000
  15    9   17   HC   C3   HC    179.974
  16    9   17   HC   C3   HC     90.000
   2   10    8  Nar  Car  Car    108.098
   2   10   18  Nar  Car   HC    125.951
   8   10   18  Car  Car   HC    125.951


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