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4-Piperidinemethanol
4-Piperidinemethanol ID: CHH15546
CAS:6457-49-4
Supplier:ChemiK Co.,Ltd.

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SMILES:N1CCC(CC1)CO	
FORMULA: C6H13NO
MASS: 115.1735
EXACT MASS: 115.0997140
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7483     0.0000 
   C   3    1.2961     0.7483     0.0000 
   C   4    1.4966     1.2962     0.7484     0.0000 
   C   5    1.2960     1.4966     1.2961     0.7483     0.0000 
   C   6    0.7482     1.2961     1.4966     1.2961     0.7483     0.0000 
   C   7    2.2449     1.9799     1.2962     0.7483     1.2961     1.9798 
   O   8    2.6980     2.5922     1.9798     1.2960     1.4966     2.2449 

              C   7      O   8
              ----------------------
   C   7    0.0000 
   O   8    0.7482     0.0000 



ATOMIC CHARGES
   N   1   -0.2180486670
   C   2    0.0887799103
   C   3    0.0214580781
   C   4    0.0358842066
   C   5    0.0214580781
   C   6    0.0887799103
   C   7    0.1821143306
   O   8   -0.2204258471


BOND ANGLES
   2    1    6   C3   N3   C3    120.007
   1    2    3   N3   C3   C3    119.995
   2    3    4   C3   C3   C3    120.001
   3    4    5   C3   C3   C3    119.994
   3    4    7   C3   C3   C3    120.001
   5    4    7   C3   C3   C3    120.005
   4    5    6   C3   C3   C3    120.005
   1    6    5   N3   C3   C3    119.998
   4    7    8   C3   C3   O3    119.998


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