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6-aminopyridin-3-ol hydrochloride
6-aminopyridin-3-ol hydrochloride ID: AN-27111
CAS:856965-37-2
Supplier:AN PharmaTech Co Ltd

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SMILES:Cl.Oc1ccc(nc1)N	45790888
FORMULA: C5H7ClN2O
MASS: 146.5749
EXACT MASS: 146.0246905
INTERATOMIC DISTANCES

             Cl   1      O   2      N   3      N   4      C   5      C   6
              ------------------------------------------------------------------
  Cl   1    0.0000 
   O   2    5.5854     0.0000 
   N   3    3.1598     2.6457     0.0000 
   N   4    3.3545     4.0000     1.7321     0.0000 
   C   5    3.6385     2.9999     1.0000     1.0001     0.0000 
   C   6    4.6345     2.6457     1.7320     1.7321     1.0000     0.0000 
   C   7    5.1444     1.7320     2.0000     2.6458     1.7320     1.0000 
   C   8    4.8177     1.0000     1.7320     3.0000     2.0000     1.7320 
   C   9    3.8692     1.7320     1.0000     2.6458     1.7320     2.0000 
   H  10    5.0120     3.1408     2.2901     1.8397     1.4158     0.6201 
   H  11    5.7617     1.8396     2.6200     3.1408     2.2901     1.4158 
   H  12    3.8181     1.8397     1.4158     3.1409     2.2901     2.6200 
   H  13    3.8593     4.3433     2.2901     0.6200     1.4158     1.8397 
   H  14    2.7871     4.3433     1.8397     0.6200     1.4158     2.2901 
   H  15    5.5501     0.6201     2.8292     4.3434     3.3533     3.1408 
   H  16    1.0000     5.2661     3.1598     3.8362     3.8692     4.8177 

              C   7      C   8      C   9      H  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    1.0000     0.0000 
   C   9    1.7320     1.0000     0.0000 
   H  10    1.4158     2.2901     2.6200     0.0000 
   H  11    0.6200     1.4158     2.2901     1.6200     0.0000 
   H  12    2.2901     1.4158     0.6201     3.2401     2.8059     0.0000 
   H  13    2.8292     3.3533     3.1408     1.7320     3.2380     3.6740 
   H  14    3.1408     3.3533     2.8292     2.4522     3.6739     3.2380 
   H  15    2.2901     1.4158     1.8397     3.6740     2.4522     1.7320 
   H  16    5.1444     4.6345     3.6385     5.2845     5.7617     3.4310 

              H  13      H  14      H  15      H  16
              --------------------------------------------
   H  13    0.0000 
   H  14    1.0739     0.0000 
   H  15    4.7432     4.6201     0.0000 
   H  16    4.4082     3.3515     5.1250     0.0000 



ATOMIC CHARGES
  Cl   1   -0.1453996612
   O   2   -0.5052484749
   N   3   -0.2371097330
   N   4   -0.3431345201
   C   5    0.1163375642
   C   6   -0.0186478467
   C   7   -0.0154354495
   C   8    0.1349972880
   C   9    0.0710495333
   H  10    0.0652823304
   H  11    0.0655493883
   H  12    0.0867438630
   H  13    0.1437066431
   H  14    0.1437066431
   H  15    0.2922027707
   H  16    0.1453996612


BOND ANGLES
   8    2   15  Car   O3   HO    120.002
   5    3    9  Car  Nar  Car    119.999
   5    4   13  Car  Npl   HC    120.000
   5    4   14  Car  Npl   HC    119.998
  13    4   14   HC  Npl   HC    120.002
   3    5    4  Nar  Car  Npl    120.001
   3    5    6  Nar  Car  Car    120.001
   4    5    6  Npl  Car  Car    119.998
   5    6    7  Car  Car  Car    120.001
   5    6   10  Car  Car   HC    119.997
   7    6   10  Car  Car   HC    120.002
   6    7    8  Car  Car  Car    119.999
   6    7   11  Car  Car   HC    120.001
   8    7   11  Car  Car   HC    120.001
   2    8    7   O3  Car  Car    119.999
   2    8    9   O3  Car  Car    120.001
   7    8    9  Car  Car  Car    120.001
   3    9    8  Nar  Car  Car    120.001
   3    9   12  Nar  Car   HC    120.002
   8    9   12  Car  Car   HC    119.997


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