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4-(1-piperidinyl)piperidine 2HCl
4-(1-piperidinyl)piperidine 2HCl ID: CHH15535
CAS:4876-60-2
Supplier:ChemiK Co.,Ltd.

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SMILES:N1CCC(CC1)N1CCCCC1.Cl.Cl	
FORMULA: C10H22Cl2N2
MASS: 241.2011
EXACT MASS: 240.1160041
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.5807     0.0000 
   C   3    1.0057     0.5806     0.0000 
   C   4    1.1613     1.0056     0.5806     0.0000 
   C   5    1.0057     1.1612     1.0056     0.5806     0.0000 
   C   6    0.5806     1.0057     1.1613     1.0057     0.5807     0.0000 
   N   7    1.7418     1.5361     1.0056     0.5806     1.0056     1.5362 
   C   8    2.0934     1.7418     1.1612     1.0056     1.5361     2.0113 
   C   9    2.6608     2.3224     1.7418     1.5362     2.0113     2.5309 
   C  10    2.9031     2.6607     2.0934     1.7418     2.0934     2.6608 
   C  11    2.6607     2.5308     2.0112     1.5361     1.7418     2.3224 
   C  12    2.0934     2.0112     1.5361     1.0056     1.1612     1.7418 
   H  13    0.5806     1.0057     1.5362     1.7418     1.5362     1.0056 
  Cl  14    1.0056     1.1613     1.7418     2.0934     2.0113     1.5361 
   H  15    1.5361     1.7418     2.3224     2.6607     2.5308     2.0112 
  Cl  16    2.0113     2.0935     2.6607     3.0723     3.0170     2.5309 

              N   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   N   7    0.0000 
   C   8    0.5806     0.0000 
   C   9    1.0057     0.5807     0.0000 
   C  10    1.1613     1.0057     0.5806     0.0000 
   C  11    1.0056     1.1612     1.0057     0.5807     0.0000 
   C  12    0.5806     1.0056     1.1613     1.0057     0.5806     0.0000 
   H  13    2.3224     2.6607     3.2328     3.4837     3.2327     2.6607 
  Cl  14    2.6607     2.9030     3.4837     3.8073     3.6259     3.0723 
   H  15    3.2327     3.4836     4.0643     4.3835     4.1868     3.6259 
  Cl  16    3.6259     3.8073     4.3836     4.7526     4.6085     4.0643 

              H  13     Cl  14      H  15     Cl  16
              --------------------------------------------
   H  13    0.0000 
  Cl  14    0.5806     0.0000 
   H  15    1.0056     0.5806     0.0000 
  Cl  16    1.5362     1.0057     0.5807     0.0000 



ATOMIC CHARGES
   N   1   -0.2179559868
   C   2    0.0900828204
   C   3    0.0347961613
   C   4    0.0603695536
   C   5    0.0347961613
   C   6    0.0900828204
   N   7   -0.2738638296
   C   8    0.0720456585
   C   9    0.0173725992
   C  10    0.0028557841
   C  11    0.0173725992
   C  12    0.0720456585
   H  13    0.1453996612
  Cl  14   -0.1453996612
   H  15    0.1453996612
  Cl  16   -0.1453996612


BOND ANGLES
   2    1    6   C3   N3   C3    119.996
   1    2    3   N3   C3   C3    120.004
   2    3    4   C3   C3   C3    120.001
   3    4    5   C3   C3   C3    120.001
   3    4    7   C3   C3   N3    120.001
   5    4    7   C3   C3   N3    119.999
   4    5    6   C3   C3   C3    120.004
   1    6    5   N3   C3   C3    119.996
   8    7   12   C3   N3   C3    120.001
   4    7    8   C3   N3   C3    119.999
   4    7   12   C3   N3   C3    120.001
   7    8    9   N3   C3   C3    120.004
   8    9   10   C3   C3   C3    119.996
   9   10   11   C3   C3   C3    119.996
  10   11   12   C3   C3   C3    120.004
   7   12   11   N3   C3   C3    120.001


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
  12    7    8    9      0.026
   4    7    8    9    179.974
   7    8    9   10      0.026
   8    9   10   11      0.026
   9   10   11   12      0.026
  10   11   12    7      0.026
   8    7   12   11      0.026
   4    7   12   11    179.974
   3    4    7    8      0.026
   3    4    7   12    179.974
   5    4    7    8    179.974
   5    4    7   12      0.026
   6    1    2    3      0.026