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6-Methyl-2,6-diaza-spiro[3.5]nonane
6-Methyl-2,6-diaza-spiro[3.5]nonane
ID: BP-11705
Supplier:BroadPharm

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SMILES:C12(CN(CCC2)C)CNC1	
FORMULA: C8H16N2
MASS: 140.2260
EXACT MASS: 140.1313485
INTERATOMIC DISTANCES

              C   1      N   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    1.0375     0.0000 
   N   3    0.8476     1.8211     0.0000 
   C   4    0.6010     0.5975     1.2603     0.0000 
   C   5    0.5994     1.3250     0.5993     0.7305     0.0000 
   C   6    0.5993     1.6240     0.5993     1.1900     0.8476     0.0000 
   C   7    0.6000     1.1985     1.2603     1.0398     1.1892     0.7310 
   C   8    1.1985     0.6000     2.0461     1.0378     1.6765     1.6771 
   C   9    1.5869     0.6010     2.2950     1.0375     1.7351     2.1852 
   C  10    1.0398     1.0378     1.8244     1.2000     1.6259     1.3290 

              C   7      C   8      C   9      C  10
              --------------------------------------------
   C   7    0.0000 
   C   8    1.0375     0.0000 
   C   9    1.7995     1.0398     0.0000 
   C  10    0.6010     0.5975     1.5863     0.0000 



ATOMIC CHARGES
   C   1    0.0469630252
   N   2   -0.2714151640
   N   3   -0.2178641961
   C   4    0.0748309133
   C   5    0.0913444515
   C   6    0.0913444515
   C   7    0.0055579055
   C   8    0.0721365327
   C   9    0.0896372276
   C  10    0.0174648528


BOND ANGLES
   4    1    5   C3   C3   C3     74.964
   4    1    6   C3   C3   C3    164.955
   4    1    7   C3   C3   C3    119.944
   5    1    6   C3   C3   C3     89.991
   5    1    7   C3   C3   C3    165.092
   6    1    7   C3   C3   C3     75.101
   4    2    8   C3   N3   C3    120.140
   4    2    9   C3   N3   C3    119.917
   8    2    9   C3   N3   C3    119.944
   5    3    6   C3   N3   C3     90.009
   1    4    2   C3   C3   N3    119.917
   1    5    3   C3   C3   N3     89.998
   1    6    3   C3   C3   N3     90.002
   1    7   10   C3   C3   C3    119.944
   2    8   10   N3   C3   C3    120.140
   7   10    8   C3   C3   C3    119.917


TORSION ANGLES
   8    2    4    1      0.026
   9    2    4    1    179.974
   5    3    6    1      0.026
   2    4    1    5    179.974
   2    4    1    6    179.974
   2    4    1    7      0.026
   3    5    1    4    179.974
   3    5    1    6      0.026
   3    5    1    7      0.026
   3    6    1    4      0.026
   3    6    1    5      0.026
   3    6    1    7    179.974
  10    7    1    4      0.026
  10    7    1    5    179.974
  10    7    1    6    179.974
  10    8    2    4      0.026
  10    8    2    9    179.974
   8   10    7    1      0.026
   6    3    5    1      0.026
   2    8   10    7      0.026