Sign In Join Free

Products Information

4-Methoxy-pyridin-2-ylamine
4-Methoxy-pyridin-2-ylamine ID: API-9474
CAS:10201-73-7
Supplier:APIchem

Get a quote


SMILES:O(c1cc(ncc1)N)C	ChemMol.com
FORMULA: C6H8N2O
MASS: 124.1405
EXACT MASS: 124.0636629
INTERATOMIC DISTANCES

              O   1      N   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   O   1    0.0000 
   N   2    3.0000     0.0000 
   N   3    3.4641     1.7321     0.0000 
   C   4    1.0000     2.0000     2.6458     0.0000 
   C   5    1.7320     1.7320     1.7321     1.0000     0.0000 
   C   6    2.6457     1.0000     1.0001     1.7320     1.0000     0.0000 
   C   7    1.7320     1.7320     3.0000     1.0000     1.7320     2.0000 
   C   8    2.6457     1.0000     2.6458     1.7320     2.0000     1.7320 
   C   9    1.0000     3.6055     4.3589     1.7320     2.6457     3.4641 
   H  10    1.8397     2.2901     1.8397     1.4158     0.6201     1.4158 
   H  11    1.8397     2.2901     3.6201     1.4158     2.2901     2.6200 
   H  12    3.1408     1.4158     3.1409     2.2901     2.6200     2.2901 
   H  13    1.1766     3.1879     4.1517     1.5200     2.5121     3.1995 
   H  14    1.6200     4.0601     4.9341     2.2901     3.2380     4.0130 
   H  15    1.1766     4.0750     4.6403     2.1114     2.9083     3.8121 
   H  16    4.0131     1.8397     0.6200     3.1408     2.2901     1.4158 
   H  17    3.5192     2.2901     0.6200     2.8292     1.8397     1.4158 

              C   7      C   8      C   9      H  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    1.0000     0.0000 
   C   9    2.0000     3.0000     0.0000 
   H  10    2.2901     2.6200     2.8292     0.0000 
   H  11    0.6201     1.4158     1.7733     2.8060     0.0000 
   H  12    1.4158     0.6201     3.3533     3.2401     1.6200     0.0000 
   H  13    1.4956     2.4825     0.6200     2.8250     1.1752     2.7824 
   H  14    2.3716     3.3533     0.6201     3.4458     2.0000     3.6200 
   H  15    2.5558     3.5505     0.6200     2.9659     2.3825     3.9390 
   H  16    3.3533     2.8292     4.8708     2.4522     3.9666     3.2380 
   H  17    3.3533     3.1408     4.4726     1.7320     3.9666     3.6740 

              H  13      H  14      H  15      H  16      H  17
              -------------------------------------------------------
   H  13    0.0000 
   H  14    0.8768     0.0000 
   H  15    1.2399     0.8769     0.0000 
   H  16    4.6147     5.4271     5.1887     0.0000 
   H  17    4.3482     5.0728     4.6766     1.0739     0.0000 



ATOMIC CHARGES
   O   1   -0.4949510497
   N   2   -0.2404905285
   N   3   -0.3430428918
   C   4    0.1247794803
   C   5    0.0196152376
   C   6    0.1195794196
   C   7   -0.0016978852
   C   8    0.0331319946
   C   9    0.0787891653
   H  10    0.0688464914
   H  11    0.0669247353
   H  12    0.0831204406
   H  13    0.0659931627
   H  14    0.0659931627
   H  15    0.0659931627
   H  16    0.1437079512
   H  17    0.1437079512


BOND ANGLES
   4    1    9  Car   O3   C3    120.001
   6    2    8  Car  Nar  Car    119.999
   6    3   16  Car  Npl   HC    119.998
   6    3   17  Car  Npl   HC    120.000
  16    3   17   HC  Npl   HC    120.002
   1    4    5   O3  Car  Car    120.001
   1    4    7   O3  Car  Car    120.001
   5    4    7  Car  Car  Car    119.999
   4    5    6  Car  Car  Car    120.001
   4    5   10  Car  Car   HC    120.002
   6    5   10  Car  Car   HC    119.997
   2    6    3  Nar  Car  Npl    120.001
   2    6    5  Nar  Car  Car    120.001
   3    6    5  Npl  Car  Car    119.998
   4    7    8  Car  Car  Car    120.001
   4    7   11  Car  Car   HC    120.002
   8    7   11  Car  Car   HC    119.997
   2    8    7  Nar  Car  Car    120.001
   2    8   12  Nar  Car   HC    120.002
   7    8   12  Car  Car   HC    119.997
   1    9   13   O3   C3   HC     90.001
   1    9   14   O3   C3   HC    179.974
   1    9   15   O3   C3   HC     89.999
  13    9   14   HC   C3   HC     89.995
  13    9   15   HC   C3   HC    179.974
  14    9   15   HC   C3   HC     90.005


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