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2-Aminoethyl methacrylate hydrochloride
2-Aminoethyl methacrylate hydrochloride ID: API-45705
CAS:2420-94-2
Supplier:APIchem

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SMILES:Cl.O(CCN)C(=O)C(=C)C	ChemMol.com
FORMULA: C6H12ClNO2
MASS: 165.6180
EXACT MASS: 165.0556563
INTERATOMIC DISTANCES

             Cl   1      O   2      O   3      N   4      C   5      C   6
              ------------------------------------------------------------------
  Cl   1    0.0000 
   O   2    4.0311     0.0000 
   O   3    2.8489     1.7320     0.0000 
   N   4    4.0807     2.6458     3.6055     0.0000 
   C   5    3.5191     1.0000     2.0000     1.7321     0.0000 
   C   6    4.1854     1.7320     2.9999     1.0001     1.0000     0.0000 
   C   7    4.5806     1.7321     1.7321     4.3590     2.6458     3.4641 
   C   8    3.7571     1.0000     1.0000     3.4641     1.7320     2.6457 
   C   9    4.6742     2.6458     2.0000     5.1962     3.4641     4.3589 
   C  10    5.4756     2.0000     2.6458     4.5826     3.0000     3.6055 
   H  11    3.1201     1.5967     2.1942     1.4157     0.6200     1.0813 
   H  12    3.0252     1.0813     1.4331     2.1829     0.6200     1.5967 
   H  13    4.5520     1.4156     2.9561     1.5968     1.0813     0.6200 
   H  14    4.7628     2.1829     3.5889     1.0813     1.5968     0.6201 
   H  15    4.6324     3.1408     4.2100     0.6200     2.2901     1.4158 
   H  16    3.5632     2.8292     3.4849     0.6200     1.8397     1.4158 
   H  17    4.0686     2.5121     1.4956     4.9156     3.1995     4.1517 
   H  18    4.8363     3.2380     2.3716     5.7415     4.0130     4.9339 
   H  19    5.2832     2.9083     2.5558     5.5323     3.8121     4.6402 
   H  20    5.9886     2.6200     3.1408     5.1928     3.6200     4.2100 
   H  21    5.5740     1.7732     2.8292     4.2029     2.7430     3.2069 
   H  22    1.0000     4.0311     2.5266     4.6742     3.7571     4.5806 

              C   7      C   8      C   9      C  10      H  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    1.0001     0.0000 
   C   9    1.0000     1.7321     0.0000 
   C  10    1.0000     1.7321     1.7320     0.0000 
   H  11    3.1512     2.1828     3.8917     3.5889     0.0000 
   H  12    2.4060     1.4156     3.1022     2.9562     0.7970     0.0000 
   H  13    3.1022     2.4059     4.0507     3.1102     1.4516     1.6889 
   H  14    3.8918     3.1512     4.8282     3.8982     1.6890     2.2064 
   H  15    4.8708     4.0130     5.7415     5.0105     2.0285     2.7806 
   H  16    4.4727     3.5191     5.2331     4.8213     1.3415     2.1355 
   H  17    1.1766     1.5201     0.6200     2.1114     3.5531     2.7563 
   H  18    1.6199     2.2901     0.6200     2.2900     4.4026     3.6063 
   H  19    1.1766     2.1115     0.6200     1.5200     4.2935     3.5240 
   H  20    1.4158     2.2901     1.8397     0.6200     4.2080     3.5651 
   H  21    1.4158     1.8397     2.2901     0.6201     3.3572     2.8259 
   H  22    4.1855     3.5191     4.0807     5.1496     3.5020     3.1760 

              H  13      H  14      H  15      H  16      H  17      H  18
              ------------------------------------------------------------------
   H  13    0.0000 
   H  14    0.7971     0.0000 
   H  15    1.9203     1.2046     0.0000 
   H  16    2.0355     1.6621     1.0739     0.0000 
   H  17    3.9245     4.6702     5.4888     4.8869     0.0000 
   H  18    4.6496     5.4201     6.3006     5.7415     0.8768     0.0000 
   H  19    4.2642     5.0577     6.0474     5.6264     1.2399     0.8768 
   H  20    3.6980     4.4781     5.6083     5.4400     2.3470     2.2901 
   H  21    2.6629     3.4289     4.5826     4.5048     2.5889     2.8736 
   H  22    4.8360     5.1909     5.2659     4.2300     3.4608     4.1376 

              H  19      H  20      H  21      H  22
              --------------------------------------------
   H  19    0.0000 
   H  20    1.4245     0.0000 
   H  21    2.1343     1.0739     0.0000 
   H  22    4.7006     5.5969     5.3553     0.0000 



ATOMIC CHARGES
  Cl   1   -0.1453996612
   O   2   -0.4601187605
   O   3   -0.2453484486
   N   4   -0.3270322092
   C   5    0.1049981059
   C   6    0.0277009022
   C   7    0.0264473421
   C   8    0.3343527769
   C   9   -0.0335035255
   C  10   -0.0889937444
   H  11    0.0710218563
   H  12    0.0710218563
   H  13    0.0455186740
   H  14    0.0455186740
   H  15    0.1183210045
   H  16    0.1183210045
   H  17    0.0279546319
   H  18    0.0279546319
   H  19    0.0279546319
   H  20    0.0539552978
   H  21    0.0539552978
   H  22    0.1453996612


BOND ANGLES
   5    2    8   C3   O3   C2    119.999
   6    4   15   C3   N3   HC    120.000
   6    4   16   C3   N3   HC    119.998
  15    4   16   HC   N3   HC    120.002
   2    5    6   O3   C3   C3    119.999
   2    5   11   O3   C3   HC    159.996
   2    5   12   O3   C3   HC     80.006
   6    5   11   C3   C3   HC     80.006
   6    5   12   C3   C3   HC    159.996
  11    5   12   HC   C3   HC     79.990
   4    6    5   N3   C3   C3    120.001
   4    6   13   N3   C3   HC    159.993
   4    6   14   N3   C3   HC     79.996
   5    6   13   C3   C3   HC     80.006
   5    6   14   C3   C3   HC    160.003
  13    6   14   HC   C3   HC     79.997
   8    7    9   C2   C2   C3    120.001
   8    7   10   C2   C2   C2    119.998
   9    7   10   C3   C2   C2    120.001
   2    8    3   O3   C2   O2    120.001
   2    8    7   O3   C2   C2    120.001
   3    8    7   O2   C2   C2    119.998
   7    9   17   C2   C3   HC     89.999
   7    9   18   C2   C3   HC    179.974
   7    9   19   C2   C3   HC     90.001
  17    9   18   HC   C3   HC     90.000
  17    9   19   HC   C3   HC    179.974
  18    9   19   HC   C3   HC     90.000
   7   10   20   C2   C2   HC    120.002
   7   10   21   C2   C2   HC    119.997
  20   10   21   HC   C2   HC    120.001


TORSION ANGLES
   8    2    5    6    179.974
   8    2    5   11      0.026
   8    2    5   12      0.026
   5    2    8    3      0.026
   5    2    8    7    179.974
  15    4    6    5    179.974
  15    4    6   13      0.026
  15    4    6   14      0.026
  16    4    6    5      0.026
  16    4    6   13    179.974
  16    4    6   14    179.974
   2    5    6    4    179.974
   2    5    6   13      0.026
   2    5    6   14      0.026
  11    5    6    4      0.026
  11    5    6   13    179.974
  11    5    6   14    179.974
  12    5    6    4      0.026
  12    5    6   13    179.974
  12    5    6   14    179.974
   9    7    8    2    179.974
   9    7    8    3      0.026
  10    7    8    2      0.026
  10    7    8    3    179.974
   8    7    9   17      0.026
   8    7    9   18      0.026
   8    7    9   19    179.974
  10    7    9   17    179.974
  10    7    9   18    179.974
  10    7    9   19      0.026
   8    7   10   20    179.974
   8    7   10   21      0.026
   9    7   10   20      0.026
   9    7   10   21    179.974