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2,7-diazaspiro[4.5]decan-3-one
2,7-diazaspiro[4.5]decan-3-one
ID: Cs00288
CAS:1158750-89-0
Supplier:Clousem

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SMILES:C1CNCC2(C1)CNC(=O)C2	
FORMULA: C8H14N2O
MASS: 154.2096
EXACT MASS: 154.1106131
INTERATOMIC DISTANCES

              C   1      C   2      N   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   C   1    0.0000 
   C   2    1.5230     0.0000 
   N   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 
   C   7    4.0765     4.1293     3.1809     1.6589     1.5230     3.0419 
   N   8    5.0742     5.4432     4.6617     3.1548     2.4643     3.7377 
   C   9    4.6616     5.4432     5.0743     3.7377     2.4643     3.1548 
   C  10    3.1809     4.1293     4.0766     3.0419     1.5230     1.6590 
   O  11    5.8700     6.8259     6.5725     5.2599     3.9409     4.3505 

              C   7      N   8      C   9      C  10      O  11
              -------------------------------------------------------
   C   7    0.0000 
   N   8    1.5231     0.0000 
   C   9    2.4643     1.5230     0.0000 
   C  10    2.4643     2.4642     1.5230     0.0000 
   O  11    3.9409     2.7139     1.5230     2.7140     0.0000 



ATOMIC CHARGES
   C   1    0.0189197767
   C   2    0.0886983025
   N   3   -0.2179808144
   C   4    0.0908018456
   C   5    0.0449285285
   C   6    0.0050642384
   C   7    0.1169041288
   N   8   -0.2053653157
   C   9    0.2414698386
   C  10    0.0899011873
   O  11   -0.2733417164


BOND ANGLES
   2    1    6   C3   C3   C3    120.001
   1    2    3   C3   C3   N3    120.001
   2    3    4   C3   N3   C3    120.000
   3    4    5   N3   C3   C3    119.999
   4    5    6   C3   C3   C3    119.999
   4    5    7   C3   C3   C3     65.998
   4    5   10   C3   C3   C3    174.000
   6    5    7   C3   C3   C3    174.003
   6    5   10   C3   C3   C3     66.001
   7    5   10   C3   C3   C3    108.002
   1    6    5   C3   C3   C3    120.000
   5    7    8   C3   C3  Nam    107.996
   7    8    9   C3  Nam   C2    108.001
   8    9   10  Nam   C2   C3    108.003
   8    9   11  Nam   C2   O2    125.997
  10    9   11   C3   C2   O2    126.000
   5   10    9   C3   C3   C2    107.998


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


CHIRAL ATOMS
   9   10    5    7      0.026