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4-(2-Aminoethyl)piperidine dihydrochloride
4-(2-Aminoethyl)piperidine dihydrochloride ID: CHH15518
CAS:90000-31-0
Supplier:ChemiK Co.,Ltd.

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SMILES:N1CCC(CC1)CCN.Cl.Cl	
FORMULA: C7H18Cl2N2
MASS: 201.1372
EXACT MASS: 200.0847039
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.6174     0.0000 
   C   3    1.0693     0.6173     0.0000 
   C   4    1.2347     1.0693     0.6174     0.0000 
   C   5    1.0692     1.2347     1.0693     0.6173     0.0000 
   C   6    0.6173     1.0693     1.2347     1.0692     0.6173     0.0000 
   C   7    1.8521     1.6334     1.0694     0.6174     1.0693     1.6334 
   C   8    2.2260     2.1386     1.6334     1.0693     1.2348     1.8521 
   N   9    2.8291     2.6910     2.1386     1.6334     1.8521     2.4694 
   H  10    3.2668     3.2079     2.6911     2.1386     2.2260     2.8291 
  Cl  11    3.8555     3.7553     3.2080     2.6911     2.8292     3.4373 
   H  12    4.3215     4.2771     3.7553     3.2079     3.2668     3.8554 
  Cl  13    4.9001     4.8217     4.2772     3.7553     3.8555     4.4518 

              C   7      C   8      N   9      H  10     Cl  11      H  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    0.6173     0.0000 
   N   9    1.0692     0.6173     0.0000 
   H  10    1.6334     1.0693     0.6174     0.0000 
  Cl  11    2.1386     1.6334     1.0694     0.6174     0.0000 
   H  12    2.6909     2.1385     1.6334     1.0692     0.6173     0.0000 
  Cl  13    3.2079     2.6910     2.1386     1.6334     1.0692     0.6174 

             Cl  13
              -----------
  Cl  13    0.0000 



ATOMIC CHARGES
   N   1   -0.2180508404
   C   2    0.0886970379
   C   3    0.0188978072
   C   4    0.0043476438
   C   5    0.0188978072
   C   6    0.0886970379
   C   7    0.0205932077
   C   8    0.1093076279
   N   9   -0.1313873291
   H  10    0.1453996612
  Cl  11   -0.1453996612
   H  12    0.1453996612
  Cl  13   -0.1453996612


BOND ANGLES
   2    1    6   C3   N3   C3    119.997
   1    2    3   N3   C3   C3    119.999
   2    3    4   C3   C3   C3    119.999
   3    4    5   C3   C3   C3    119.997
   3    4    7   C3   C3   C3    119.999
   5    4    7   C3   C3   C3    120.004
   4    5    6   C3   C3   C3    120.004
   1    6    5   N3   C3   C3    120.004
   4    7    8   C3   C3   C3    120.004
   7    8    9   C3   C3   N3    120.004


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