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Methyl 4-piperidinecarboxylate
Methyl 4-piperidinecarboxylate ID: CHH15548
CAS:2971-79-1
Supplier:ChemiK Co.,Ltd.

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SMILES:N1CCC(CC1)C(=O)OC	
FORMULA: C7H13NO2
MASS: 143.1836
EXACT MASS: 143.0946287
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7482     0.0000 
   C   3    1.2960     0.7483     0.0000 
   C   4    1.4966     1.2961     0.7483     0.0000 
   C   5    1.2961     1.4966     1.2961     0.7484     0.0000 
   C   6    0.7483     1.2961     1.4966     1.2962     0.7483     0.0000 
   C   7    2.2448     1.9798     1.2960     0.7482     1.2961     1.9798 
   O   8    2.6980     2.5922     1.9798     1.2961     1.4966     2.2449 
   O   9    2.6980     2.2449     1.4966     1.2960     1.9798     2.5922 
   C  10    2.5921     1.9798     1.2961     1.4966     2.2449     2.6980 

              C   7      O   8      O   9      C  10
              --------------------------------------------
   C   7    0.0000 
   O   8    0.7484     0.0000 
   O   9    0.7483     1.2961     0.0000 
   C  10    1.2961     1.9799     0.7484     0.0000 



ATOMIC CHARGES
   N   1   -0.2180230058
   C   2    0.0892561175
   C   3    0.0299348775
   C   4    0.1019209210
   C   5    0.0299348775
   C   6    0.0892561175
   C   7    0.3166320905
   O   8   -0.2501171990
   O   9   -0.4443950490
   C  10    0.2556002523


BOND ANGLES
   2    1    6   C3   N3   C3    120.007
   1    2    3   N3   C3   C3    119.998
   2    3    4   C3   C3   C3    120.005
   3    4    5   C3   C3   C3    119.994
   3    4    7   C3   C3   C2    120.005
   5    4    7   C3   C3   C2    120.001
   4    5    6   C3   C3   C3    120.001
   1    6    5   N3   C3   C3    119.995
   8    7    9   O2   C2   O3    119.994
   4    7    8   C3   C2   O2    120.001
   4    7    9   C3   C2   O3    120.005
   7    9   10   C2   O3   C3    119.994


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
   8    7    9   10    179.974
   4    7    9   10      0.026
   3    4    7    8    179.974
   3    4    7    9      0.026
   5    4    7    8      0.026
   5    4    7    9    179.974