SMILES:C1(=O)CC(CCC1)NC(=O)OC(C)(C)C	ChemMol.com

FORMULA: C11H19NO3
MASS: 213.2735
EXACT MASS: 213.1364935
INTERATOMIC DISTANCES

              C   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.5230     0.0000 
   C   3    2.6379     1.5230     0.0000 
   C   4    3.0460     2.6379     1.5230     0.0000 
   C   5    2.6379     3.0460     2.6379     1.5230     0.0000 
   C   6    1.5230     2.6379     3.0460     2.6379     1.5230     0.0000 
   O   7    1.5230     2.6379     4.0294     4.5689     4.0295     2.6379 
   N   8    4.0295     2.6379     1.5230     2.6379     4.0295     4.5690 
   C   9    5.2759     4.0295     2.6380     3.0461     4.5690     5.4913 
   O  10    5.4913     4.5690     3.0461     2.6380     4.0295     5.2759 
   O  11    6.6386     5.2758     4.0295     4.5690     6.0920     6.9793 
   C  12    7.9138     6.6386     5.2759     5.4913     6.9793     8.0590 
   C  13    9.2641     7.9137     6.6386     6.9793     8.4797     9.5111 
   C  14    9.2641     8.0589     6.6386     6.6386     8.0589     9.2641 
   C  15    8.0590     6.9793     5.4913     5.2759     6.6386     7.9138 

              O   7      N   8      C   9      O  10      O  11      C  12
              ------------------------------------------------------------------
   O   7    0.0000 
   N   8    5.2758     0.0000 
   C   9    6.6386     1.5230     0.0000 
   O  10    6.9793     2.6379     1.5230     0.0000 
   O  11    7.9137     2.6379     1.5230     2.6379     0.0000 
   C  12    9.2641     4.0295     2.6379     3.0460     1.5230     0.0000 
   C  13   10.5516     5.2758     4.0294     4.5689     2.6379     1.5230 
   C  14   10.6609     5.4912     4.0294     4.0294     3.0460     1.5230 
   C  15    9.5111     4.5690     3.0460     2.6379     2.6379     1.5230 

              C  13      C  14      C  15
              ---------------------------------
   C  13    0.0000 
   C  14    1.5230     0.0000 
   C  15    2.6379     1.5230     0.0000 



ATOMIC CHARGES
   C   1    0.1523826647
   C   2    0.0862135182
   C   3    0.1060412780
   C   4    0.0226706243
   C   5    0.0095247246
   C   6    0.0646207913
   O   7   -0.2960005625
   N   8   -0.1700513183
   C   9    0.4208599537
   O  10   -0.2245677649
   O  11   -0.4407975594
   C  12    0.1378771127
   C  13    0.0437421792
   C  14    0.0437421792
   C  15    0.0437421792


BOND ANGLES
   6    1    2   C3   C2   C3    119.999
   1    2    3   C2   C3   C3    120.000
   7    1    2   O2   C2   C3    120.000
   1    2    3   C2   C3   C3    120.000
   8    3    4  Nam   C3   C3    119.999
   3    4    5   C3   C3   C3    120.001
   2    1    6   C3   C2   C3    119.999
   7    1    6   O2   C2   C3    120.001
   2    1    7   C3   C2   O2    120.000
   6    1    7   C3   C2   O2    120.001
  11    9   10   O3   C2   O2    120.001
  10    9   11   O2   C2   O3    120.001
   9   11   12   C2   O3   C3    120.000
  14   12   13   C3   C3   C3     60.002
  15   12   13   C3   C3   C3    120.001
  13   12   14   C3   C3   C3     60.002
  15   12   14   C3   C3   C3     59.999
  13   12   15   C3   C3   C3    120.001
  14   12   15   C3   C3   C3     59.999
   4    3    8   C3   C3  Nam    119.999
   3    8    9   C3  Nam   C2    120.002


TORSION ANGLES
   6    1    2    3      0.026
   7    1    2    3    179.974
   1    2    3    4      0.026
   1    2    3    8    179.974
   2    3    4    5      0.026
   8    3    4    5    179.974
   3    4    5    6      0.026
   4    5    6    1      0.026
   2    1    6    5      0.026
   7    1    6    5    179.974
  10    9   11   12      0.026
   8    9   11   12    179.974
   9   11   12   13    179.974
   9   11   12   14      0.026
   9   11   12   15      0.026
   3    8    9   10      0.026
   3    8    9   11    179.974
   2    3    8    9    179.974
   4    3    8    9      0.026


CHIRAL ATOMS
   C     3 is chiral: counterclockwise